(1S,6R)-6-[(2-methoxy-5-methyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6R)-6-[(2-methoxy-5-methyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6R)-6-[(2-methoxy-5-methyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6R)-6-[(2-methoxy-5-methylanilino)-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6R)-6-[(2-methoxy-5-methylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6R)-6-[(2-methoxy-5-methyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C2CC=CCC2C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O

InChI

InChI=1S/C16H19NO4/c1-10-7-8-14(21-2)13(9-10)17-15(18)11-5-3-4-6-12(11)16(19)20/h3-4,7-9,11-12H,5-6H2,1-2H3,(H,17,18)(H,19,20)/t11-,12+/m1/s1