3-methyl-4-[4-(4-nitrophenyl)phenyl]-3-oxidanyl-butanoic acid

Systemtic Name: 3-methyl-4-[4-(4-nitrophenyl)phenyl]-3-oxidanyl-butanoic acid Openeye Name: 3-hydroxy-3-methyl-4-[4-(4-nitrophenyl)phenyl]butanoic acid CAS Name: 3-hydroxy-3-methyl-4-[4-(4-nitrophenyl)phenyl]butanoic acid IUPAC Name: 3-hydroxy-3-methyl-4-[4-(4-nitrophenyl)phenyl]butanoic acid Traditional Name: 3-hydroxy-3-methyl-4-[4-(4-nitrophenyl)phenyl]butyric acid Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO5/c1-17(21,11-16(19)20)10-12-2-4-13(5-3-12)14-6-8-15(9-7-14)18(22)23/h2-9,21H,10-11H2,1H3,(H,19,20)