2-butyl-3-(3-chlorophenyl)-1-oxidanylidene-N-(2-pyrrolidin-1-ylethyl)-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-butyl-3-(3-chlorophenyl)-1-oxidanylidene-N-(2-pyrrolidin-1-ylethyl)-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-butyl-3-(3-chlorophenyl)-1-oxo-N-(2-pyrrolidin-1-ylethyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-butyl-3-(3-chlorophenyl)-1-oxo-N-[2-(1-pyrrolidinyl)ethyl]-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-butyl-3-(3-chlorophenyl)-1-oxo-N-(2-pyrrolidin-1-ylethyl)-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-butyl-3-(3-chlorophenyl)-1-keto-N-(2-pyrrolidinoethyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C26H32ClN3O2 MolecularWeight: 454.00418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCCN3CCCC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCCN3CCCC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H32ClN3O2/c1-2-3-16-30-24(19-9-8-10-20(27)18-19)23(21-11-4-5-12-22(21)26(30)32)25(31)28-13-17-29-14-6-7-15-29/h4-5,8-12,18,23-24H,2-3,6-7,13-17H2,1H3,(H,28,31)