2-(1-methoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-yl)-N-(2-nitrophenyl)-2-oxidanylidene-ethanamide

Systemtic Name: 2-(1-methoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-yl)-N-(2-nitrophenyl)-2-oxidanylidene-ethanamide Openeye Name: 2-(1-methoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-yl)-N-(2-nitrophenyl)-2-oxo-acetamide CAS Name: 2-(1-methoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-yl)-N-(2-nitrophenyl)-2-oxoacetamide IUPAC Name: 2-(1-methoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-yl)-N-(2-nitrophenyl)-2-oxoacetamide Traditional Name: 2-keto-2-(1-methoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-yl)-N-(2-nitrophenyl)acetamide Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(N1)(C(=O)C(=O)NC3=CC=CC=C3[N+](=O)[O-])OC)C

Isomeric SMILES

CC1(CC2=CC=CC=C2C(N1)(C(=O)C(=O)NC3=CC=CC=C3[N+](=O)[O-])OC)C

InChI

InChI=1S/C20H21N3O5/c1-19(2)12-13-8-4-5-9-14(13)20(22-19,28-3)17(24)18(25)21-15-10-6-7-11-16(15)23(26)27/h4-11,22H,12H2,1-3H3,(H,21,25)