[1,2-bis(4-methylphenyl)-2-oxidanylidene-ethyl] 4-nitrobenzoate

Systemtic Name: [1,2-bis(4-methylphenyl)-2-oxidanylidene-ethyl] 4-nitrobenzoate Openeye Name: [2-oxo-1,2-bis(p-tolyl)ethyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [1,2-bis(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [1,2-bis(4-methylphenyl)-2-oxoethyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-keto-1,2-bis(p-tolyl)ethyl] ester Formula: C23H19NO5 MolecularWeight: 389.40066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(C(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H19NO5/c1-15-3-7-17(8-4-15)21(25)22(18-9-5-16(2)6-10-18)29-23(26)19-11-13-20(14-12-19)24(27)28/h3-14,22H,1-2H3