(1R,6S)-6-[[(2-hydroxyphenyl)carbonylamino]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6S)-6-[[(2-hydroxyphenyl)carbonylamino]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-[[(2-hydroxybenzoyl)amino]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[[[(2-hydroxyphenyl)-oxomethyl]hydrazo]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-[[(2-hydroxybenzoyl)amino]carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-3,4-dimethyl-6-[(salicyloylamino)carbamoyl]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=C2O)C(=O)[O-])C

Isomeric SMILES

CC1=C(C[C@H]([C@H](C1)C(=O)NNC(=O)C2=CC=CC=C2O)C(=O)[O-])C

InChI

InChI=1S/C17H20N2O5/c1-9-7-12(13(17(23)24)8-10(9)2)16(22)19-18-15(21)11-5-3-4-6-14(11)20/h3-6,12-13,20H,7-8H2,1-2H3,(H,18,21)(H,19,22)(H,23,24)/p-1/t12-,13+/m0/s1