(1S,6S)-6-[(4-methoxy-3-oxidanyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6S)-6-[(4-methoxy-3-oxidanyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6S)-6-[(3-hydroxy-4-methoxy-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6S)-6-[(3-hydroxy-4-methoxyanilino)-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6S)-6-[(3-hydroxy-4-methoxyphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6S)-6-[(3-hydroxy-4-methoxy-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C15H17NO5 MolecularWeight: 291.29918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CC=CCC2C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)O

InChI

InChI=1S/C15H17NO5/c1-21-13-7-6-9(8-12(13)17)16-14(18)10-4-2-3-5-11(10)15(19)20/h2-3,6-8,10-11,17H,4-5H2,1H3,(H,16,18)(H,19,20)/t10-,11-/m0/s1