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

Systemtic Name: 4-[4-(4-methyl-2-nitro-phenyl)phenyl]-4-oxidanyl-butanoic acid Openeye Name: 4-hydroxy-4-[4-(4-methyl-2-nitro-phenyl)phenyl]butanoic acid CAS Name: 4-hydroxy-4-[4-(4-methyl-2-nitrophenyl)phenyl]butanoic acid IUPAC Name: 4-hydroxy-4-[4-(4-methyl-2-nitrophenyl)phenyl]butanoic acid Traditional Name: 4-hydroxy-4-[4-(4-methyl-2-nitro-phenyl)phenyl]butyric acid Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO5/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/h2-7,10,16,19H,8-9H2,1H3,(H,20,21)