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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)C2=CC=CC=C2[N+](=O)[O-])(C(=O)O)O

Isomeric SMILES

CC(CCC1=CC=C(C=C1)C2=CC=CC=C2[N+](=O)[O-])(C(=O)O)O

InChI

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