methyl 4-(3-nitrophenyl)-5,7-dihydrobenzo[d][2]benzoxepine-7-carboxylate

Systemtic Name: methyl 4-(3-nitrophenyl)-5,7-dihydrobenzo[d][2]benzoxepine-7-carboxylate Openeye Name: methyl 4-(3-nitrophenyl)-5,7-dihydrobenzo[d][2]benzoxepine-7-carboxylate CAS Name: 4-(3-nitrophenyl)-5,7-dihydrobenzo[d][2]benzoxepin-7-carboxylic acid methyl ester IUPAC Name: methyl 4-(3-nitrophenyl)-5,7-dihydrobenzo[d][2]benzoxepine-7-carboxylate Traditional Name: 4-(3-nitrophenyl)-5,7-dihydrobenzo[d][2]benzoxepin-7-carboxylic acid methyl ester Formula: C22H17NO5 MolecularWeight: 375.37408

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C2=CC=CC=C2C3=CC=CC(=C3CO1)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1C2=CC=CC=C2C3=CC=CC(=C3CO1)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17NO5/c1-27-22(24)21-19-9-3-2-8-17(19)18-11-5-10-16(20(18)13-28-21)14-6-4-7-15(12-14)23(25)26/h2-12,21H,13H2,1H3