2-(dibutylamino)-N-[4-(4,4-dimethyl-3-oxidanylidene-1,2-dihydroisoquinolin-1-yl)phenyl]ethanamide

Systemtic Name: 2-(dibutylamino)-N-[4-(4,4-dimethyl-3-oxidanylidene-1,2-dihydroisoquinolin-1-yl)phenyl]ethanamide Openeye Name: 2-(dibutylamino)-N-[4-(4,4-dimethyl-3-oxo-1,2-dihydroisoquinolin-1-yl)phenyl]acetamide CAS Name: 2-(dibutylamino)-N-[4-(4,4-dimethyl-3-oxo-1,2-dihydroisoquinolin-1-yl)phenyl]acetamide IUPAC Name: 2-(dibutylamino)-N-[4-(4,4-dimethyl-3-oxo-1,2-dihydroisoquinolin-1-yl)phenyl]acetamide Traditional Name: 2-(dibutylamino)-N-[4-(3-keto-4,4-dimethyl-1,2-dihydroisoquinolin-1-yl)phenyl]acetamide Formula: C27H37N3O2 MolecularWeight: 435.60158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CC(=O)NC1=CC=C(C=C1)C2C3=CC=CC=C3C(C(=O)N2)(C)C

Isomeric SMILES

CCCCN(CCCC)CC(=O)NC1=CC=C(C=C1)C2C3=CC=CC=C3C(C(=O)N2)(C)C

InChI

InChI=1S/C27H37N3O2/c1-5-7-17-30(18-8-6-2)19-24(31)28-21-15-13-20(14-16-21)25-22-11-9-10-12-23(22)27(3,4)26(32)29-25/h9-16,25H,5-8,17-19H2,1-4H3,(H,28,31)(H,29,32)