(1S,6R)-1-benzamido-3,4-dimethyl-6-oxidanyl-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6R)-1-benzamido-3,4-dimethyl-6-oxidanyl-cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6R)-1-benzamido-6-hydroxy-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6R)-1-benzamido-6-hydroxy-3,4-dimethyl-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6R)-1-benzamido-6-hydroxy-3,4-dimethylcyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6R)-1-benzamido-6-hydroxy-3,4-dimethyl-cyclohex-3-ene-1-carboxylic acid Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)O)(C(=O)O)NC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C[C@]([C@@H](C1)O)(C(=O)O)NC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C16H19NO4/c1-10-8-13(18)16(15(20)21,9-11(10)2)17-14(19)12-6-4-3-5-7-12/h3-7,13,18H,8-9H2,1-2H3,(H,17,19)(H,20,21)/t13-,16+/m1/s1