4-(Dimethylamino)-2-Isopropyl-2-Phenylvaleronitrile Cyclamate
[CAS# 100700-37-6]

Identification

• Name: 4-(Dimethylamino)-2-Isopropyl-2-Phenylvaleronitrile Cyclamate
• Synonyms: (3-Cyano-4-Methyl-3-Phenyl-Pentyl)-Dimethyl-Ammonium; N-Cyclohexylsulfamate; (3-Cyano-4-Methyl-3-Phenylpentyl)-Dimethylammonium; N-Cyclohexylsulfamate; (3-Cyano-4-Methyl-3-Phenyl-Pentyl)-Dimethyl-Azanium; N-Cyclohexylsulfamate
• Molecular Formula: C₂₁H₃₅N₃O₃S
• Molecular Weight: 409.59
• CAS Registry Number: 100700-37-6
• SMILES: O=[S]([O-])(=O)NC1CCCCC1.C2=C(C(C(C)C)(CC[NH+](C)C)C#N)C=CC=C2
• InChI: 1S/C15H22N2.C6H13NO3S/c1-13(2)15(12-16,10-11-17(3)4)14-8-6-5-7-9-14;8-11(9,10)7-6-4-2-1-3-5-6/h5-9,13H,10-11H2,1-4H3;6-7H,1-5H2,(H,8,9,10)
• InChIKey: TYHONNDWIFYQMB-UHFFFAOYSA-N