(1R,6R)-6-[[(3-hydroxyphenyl)carbonylamino]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6R)-6-[[(3-hydroxyphenyl)carbonylamino]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6R)-6-[[(3-hydroxybenzoyl)amino]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6R)-6-[[[(3-hydroxyphenyl)-oxomethyl]hydrazo]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6R)-6-[[(3-hydroxybenzoyl)amino]carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,6R)-6-[[(3-hydroxybenzoyl)amino]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Formula: C17H19N2O5- MolecularWeight: 331.34316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O5/c1-9-6-13(14(17(23)24)7-10(9)2)16(22)19-18-15(21)11-4-3-5-12(20)8-11/h3-5,8,13-14,20H,6-7H2,1-2H3,(H,18,21)(H,19,22)(H,23,24)/p-1/t13-,14-/m1/s1