methyl 2-(4-nitrophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl 2-(4-nitrophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl 2-(4-nitrophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 2-(4-nitrophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-nitrophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-(4-nitrophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=CC=CC=C2CN1C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1CC2=CC=CC=C2CN1C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O4/c1-23-17(20)16-10-12-4-2-3-5-13(12)11-18(16)14-6-8-15(9-7-14)19(21)22/h2-9,16H,10-11H2,1H3