2-[6,7-dimethoxy-2-(4-nitrophenyl)carbonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethanamide

Systemtic Name: 2-[6,7-dimethoxy-2-(4-nitrophenyl)carbonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethanamide Openeye Name: 2-[6,7-dimethoxy-2-(4-nitrobenzoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetamide CAS Name: 2-[6,7-dimethoxy-2-[(4-nitrophenyl)-oxomethyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetamide IUPAC Name: 2-[6,7-dimethoxy-2-(4-nitrobenzoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetamide Traditional Name: 2-[6,7-dimethoxy-2-(4-nitrobenzoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetamide Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])CC(=O)N)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])CC(=O)N)OC

InChI

InChI=1S/C20H21N3O6/c1-28-17-9-13-7-8-22(16(11-19(21)24)15(13)10-18(17)29-2)20(25)12-3-5-14(6-4-12)23(26)27/h3-6,9-10,16H,7-8,11H2,1-2H3,(H2,21,24)