6-[(2-nitrophenyl)carbamoyl]-2,5-diphenyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[(2-nitrophenyl)carbamoyl]-2,5-diphenyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[(2-nitrophenyl)carbamoyl]-2,5-diphenyl-cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[(2-nitroanilino)-oxomethyl]-2,5-diphenyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[(2-nitrophenyl)carbamoyl]-2,5-diphenylcyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[(2-nitrophenyl)carbamoyl]-2,5-diphenyl-cyclohex-3-ene-1-carboxylic acid Formula: C26H22N2O5 MolecularWeight: 442.46328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C=CC(C(C2C(=O)NC3=CC=CC=C3[N+](=O)[O-])C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2C=CC(C(C2C(=O)NC3=CC=CC=C3[N+](=O)[O-])C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C26H22N2O5/c29-25(27-21-13-7-8-14-22(21)28(32)33)23-19(17-9-3-1-4-10-17)15-16-20(24(23)26(30)31)18-11-5-2-6-12-18/h1-16,19-20,23-24H,(H,27,29)(H,30,31)