(6S)-2,6-dimethyl-6-[(S)-(4-nitrophenyl)-oxidanyl-methyl]cyclohex-2-en-1-one

Systemtic Name: (6S)-2,6-dimethyl-6-[(S)-(4-nitrophenyl)-oxidanyl-methyl]cyclohex-2-en-1-one Openeye Name: (6S)-6-[(S)-hydroxy-(4-nitrophenyl)methyl]-2,6-dimethyl-cyclohex-2-en-1-one CAS Name: (6S)-6-[(S)-hydroxy-(4-nitrophenyl)methyl]-2,6-dimethyl-1-cyclohex-2-enone IUPAC Name: (6S)-6-[(S)-hydroxy-(4-nitrophenyl)methyl]-2,6-dimethylcyclohex-2-en-1-one Traditional Name: (6S)-6-[(S)-hydroxy-(4-nitrophenyl)methyl]-2,6-dimethyl-cyclohex-2-en-1-one Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17NO4/c1-10-4-3-9-15(2,13(10)17)14(18)11-5-7-12(8-6-11)16(19)20/h4-8,14,18H,3,9H2,1-2H3/t14-,15+/m0/s1