4-cyano-3-(4-nitrophenyl)-4-phenyl-butanoic acid

Systemtic Name: 4-cyano-3-(4-nitrophenyl)-4-phenyl-butanoic acid Openeye Name: 4-cyano-3-(4-nitrophenyl)-4-phenyl-butanoic acid CAS Name: 4-cyano-3-(4-nitrophenyl)-4-phenylbutanoic acid IUPAC Name: 4-cyano-3-(4-nitrophenyl)-4-phenylbutanoic acid Traditional Name: 4-cyano-3-(4-nitrophenyl)-4-phenyl-butyric acid Formula: C17H14N2O4 MolecularWeight: 310.30406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)C(CC(=O)O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C#N)C(CC(=O)O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O4/c18-11-16(12-4-2-1-3-5-12)15(10-17(20)21)13-6-8-14(9-7-13)19(22)23/h1-9,15-16H,10H2,(H,20,21)