[(1R)-1,2-bis(4-methylphenyl)-2-oxidanylidene-ethyl] 3-nitrobenzoate

Systemtic Name: [(1R)-1,2-bis(4-methylphenyl)-2-oxidanylidene-ethyl] 3-nitrobenzoate Openeye Name: [(1R)-2-oxo-1,2-bis(p-tolyl)ethyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [(1R)-1,2-bis(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [(1R)-1,2-bis(4-methylphenyl)-2-oxoethyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [(1R)-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(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C23H19NO5/c1-15-6-10-17(11-7-15)21(25)22(18-12-8-16(2)9-13-18)29-23(26)19-4-3-5-20(14-19)24(27)28/h3-14,22H,1-2H3/t22-/m1/s1