2-methyl-4-(3-nitro-4-phenyl-phenyl)-2-oxidanyl-butanoic acid

Systemtic Name: 2-methyl-4-(3-nitro-4-phenyl-phenyl)-2-oxidanyl-butanoic acid Openeye Name: 2-hydroxy-2-methyl-4-(3-nitro-4-phenyl-phenyl)butanoic acid CAS Name: 2-hydroxy-2-methyl-4-(3-nitro-4-phenylphenyl)butanoic acid IUPAC Name: 2-hydroxy-2-methyl-4-(3-nitro-4-phenylphenyl)butanoic acid Traditional Name: 2-hydroxy-2-methyl-4-(3-nitro-4-phenyl-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)10-9-12-7-8-14(15(11-12)18(22)23)13-5-3-2-4-6-13/h2-8,11,21H,9-10H2,1H3,(H,19,20)