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

Systemtic Name: 3-methyl-4-(3-nitro-4-phenyl-phenyl)-2-oxidanyl-butanoic acid Openeye Name: 2-hydroxy-3-methyl-4-(3-nitro-4-phenyl-phenyl)butanoic acid CAS Name: 2-hydroxy-3-methyl-4-(3-nitro-4-phenylphenyl)butanoic acid IUPAC Name: 2-hydroxy-3-methyl-4-(3-nitro-4-phenylphenyl)butanoic acid Traditional Name: 2-hydroxy-3-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(CC1=CC(=C(C=C1)C2=CC=CC=C2)[N+](=O)[O-])C(C(=O)O)O

Isomeric SMILES

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

InChI

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