2-(Butylaminocarbonyl)-5,6-Dihydro-8,9-Dimethoxypyrrolo[2,1-a]Isoquinoline-3-Carboxylic Acid
[CAS# 39731-66-3]

Identification

• Name: 2-(Butylaminocarbonyl)-5,6-Dihydro-8,9-Dimethoxypyrrolo[2,1-a]Isoquinoline-3-Carboxylic Acid
• Synonyms: 2-(Butylamino-Oxomethyl)-8,9-Dimethoxy-5,6-Dihydropyrrolo[5,1-A]Isoquinoline-3-Carboxylic Acid; 2-(Butylcarbamoyl)-8,9-Dimethoxy-5,6-Dihydropyrrolo(2,1-A)Isoquinoline-3-Carboxylic Acid; Brn 0455690
• Molecular Formula: C₂₀H₂₄N₂O₅
• Molecular Weight: 372.42
• CAS Registry Number: 39731-66-3
• SMILES: C1=C(C(=CC2=C1CC[N]3C2=CC(=C3C(=O)O)C(=O)NCCCC)OC)OC
• InChI: 1S/C20H24N2O5/c1-4-5-7-21-19(23)14-10-15-13-11-17(27-3)16(26-2)9-12(13)6-8-22(15)18(14)20(24)25/h9-11H,4-8H2,1-3H3,(H,21,23)(H,24,25)
• InChIKey: AYUJNWLCYNCQTK-UHFFFAOYSA-N

Properties

• Density: 1.299g/cm³ (Cal.)
• Boiling point: 637.012°C at 760 mmHg (Cal.)
• Flash point: 339.053°C (Cal.)