methyl 2-[6,7-dimethoxy-2-(3-methyl-4-nitro-phenyl)carbonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: methyl 2-[6,7-dimethoxy-2-(3-methyl-4-nitro-phenyl)carbonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate Openeye Name: methyl 2-[6,7-dimethoxy-2-(3-methyl-4-nitro-benzoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetate CAS Name: 2-[6,7-dimethoxy-2-[(3-methyl-4-nitrophenyl)-oxomethyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6,7-dimethoxy-2-(3-methyl-4-nitrobenzoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[6,7-dimethoxy-2-(3-methyl-4-nitro-benzoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester Formula: C22H24N2O7 MolecularWeight: 428.43516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCC3=CC(=C(C=C3C2CC(=O)OC)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCC3=CC(=C(C=C3C2CC(=O)OC)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H24N2O7/c1-13-9-15(5-6-17(13)24(27)28)22(26)23-8-7-14-10-19(29-2)20(30-3)11-16(14)18(23)12-21(25)31-4/h5-6,9-11,18H,7-8,12H2,1-4H3