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

Systemtic Name: 2-butyl-3-(3-chlorophenyl)-N-cyclopropyl-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-butyl-3-(3-chlorophenyl)-N-cyclopropyl-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-butyl-3-(3-chlorophenyl)-N-cyclopropyl-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-butyl-3-(3-chlorophenyl)-N-cyclopropyl-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-butyl-3-(3-chlorophenyl)-N-cyclopropyl-1-keto-3,4-dihydroisoquinoline-4-carboxamide Formula: C23H25ClN2O2 MolecularWeight: 396.9098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H25ClN2O2/c1-2-3-13-26-21(15-7-6-8-16(24)14-15)20(22(27)25-17-11-12-17)18-9-4-5-10-19(18)23(26)28/h4-10,14,17,20-21H,2-3,11-13H2,1H3,(H,25,27)