4-[4-(4-methyl-2-nitro-phenyl)phenyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(4-methyl-2-nitro-phenyl)phenyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(4-methyl-2-nitro-phenyl)phenyl]-4-oxo-butanoic acid CAS Name: 4-[4-(4-methyl-2-nitrophenyl)phenyl]-4-oxobutanoic acid IUPAC Name: 4-[4-(4-methyl-2-nitrophenyl)phenyl]-4-oxobutanoic acid Traditional Name: 4-keto-4-[4-(4-methyl-2-nitro-phenyl)phenyl]butyric acid Formula: C17H15NO5 MolecularWeight: 313.3047

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15NO5/c1-11-2-7-14(15(10-11)18(22)23)12-3-5-13(6-4-12)16(19)8-9-17(20)21/h2-7,10H,8-9H2,1H3,(H,20,21)