N-(1-Methyl-9H-Pyrido[3,4-b]Indol-3-Ylmethyl)-3,4-Dimethoxybenzamide
[CAS# 63885-53-0]

Identification

• Name: N-(1-Methyl-9H-Pyrido[3,4-b]Indol-3-Ylmethyl)-3,4-Dimethoxybenzamide
• Synonyms: 3,4-Dimethoxy-N-[(1-Methyl-9H-$B-Carbolin-3-Yl)Methyl]Benzamide; 3-(3,4-Dimethoxybenzamidomethyl) Harmane; 3-(3,4-Dimethoxybenzamidomethyl)-1-Methyl-9H-Pyrid(3,4-B)Indole
• Molecular Formula: C₂₂H₂₁N₃O₃
• Molecular Weight: 375.43
• CAS Registry Number: 63885-53-0
• SMILES: C1=C(C(=CC=C1C(=O)NCC3=NC(=C2[NH]C4=C(C2=C3)C=CC=C4)C)OC)OC
• InChI: 1S/C22H21N3O3/c1-13-21-17(16-6-4-5-7-18(16)25-21)11-15(24-13)12-23-22(26)14-8-9-19(27-2)20(10-14)28-3/h4-11,25H,12H2,1-3H3,(H,23,26)
• InChIKey: DUTHEJYRWZFCAM-UHFFFAOYSA-N

Properties

• Density: 1.275g/cm³ (Cal.)
• Boiling point: 610.452°C at 760 mmHg (Cal.)
• Flash point: 322.99°C (Cal.)