2-butyl-3-(3-chlorophenyl)-1-oxidanylidene-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-butyl-3-(3-chlorophenyl)-1-oxidanylidene-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-butyl-3-(3-chlorophenyl)-1-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-butyl-3-(3-chlorophenyl)-1-oxo-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-butyl-3-(3-chlorophenyl)-1-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-butyl-3-(3-chlorophenyl)-1-keto-N-[3-(2-ketopyrrolidino)propyl]-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H32ClN3O3 MolecularWeight: 482.01428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCCCN3CCCC3=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NCCCN3CCCC3=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C27H32ClN3O3/c1-2-3-17-31-25(19-9-6-10-20(28)18-19)24(21-11-4-5-12-22(21)27(31)34)26(33)29-14-8-16-30-15-7-13-23(30)32/h4-6,9-12,18,24-25H,2-3,7-8,13-17H2,1H3,(H,29,33)