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

Systemtic Name: 2-butyl-3-(3-chlorophenyl)-1-oxidanylidene-N-(2-piperidin-1-ylethyl)-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-butyl-3-(3-chlorophenyl)-1-oxo-N-[2-(1-piperidyl)ethyl]-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-butyl-3-(3-chlorophenyl)-1-oxo-N-[2-(1-piperidinyl)ethyl]-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-butyl-3-(3-chlorophenyl)-1-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-butyl-3-(3-chlorophenyl)-1-keto-N-(2-piperidinoethyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H34ClN3O2 MolecularWeight: 468.03076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCCN3CCCCC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCCN3CCCCC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C27H34ClN3O2/c1-2-3-17-31-25(20-10-9-11-21(28)19-20)24(22-12-5-6-13-23(22)27(31)33)26(32)29-14-18-30-15-7-4-8-16-30/h5-6,9-13,19,24-25H,2-4,7-8,14-18H2,1H3,(H,29,32)