[4-(2-benzamido-3-methoxy-3-oxidanylidene-propyl)phenyl] 3-nitrobenzoate

Systemtic Name: [4-(2-benzamido-3-methoxy-3-oxidanylidene-propyl)phenyl] 3-nitrobenzoate Openeye Name: [4-(2-benzamido-3-methoxy-3-oxo-propyl)phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-(2-benzamido-3-methoxy-3-oxopropyl)phenyl] ester IUPAC Name: [4-(2-benzamido-3-methoxy-3-oxopropyl)phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-(2-benzamido-3-keto-3-methoxy-propyl)phenyl] ester Formula: C24H20N2O7 MolecularWeight: 448.4248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20N2O7/c1-32-24(29)21(25-22(27)17-6-3-2-4-7-17)14-16-10-12-20(13-11-16)33-23(28)18-8-5-9-19(15-18)26(30)31/h2-13,15,21H,14H2,1H3,(H,25,27)