(1S,6S)-6-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6S)-6-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6S)-6-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-[[2-(methylcarbamoyl)anilino]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6S)-6-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-6-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C16H17N2O4- MolecularWeight: 301.31718

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=CC=C1NC(=O)C2CC=CCC2C(=O)[O-]

Isomeric SMILES

CNC(=O)C1=CC=CC=C1NC(=O)[C@H]2CC=CC[C@@H]2C(=O)[O-]

InChI

InChI=1S/C16H18N2O4/c1-17-14(19)12-8-4-5-9-13(12)18-15(20)10-6-2-3-7-11(10)16(21)22/h2-5,8-11H,6-7H2,1H3,(H,17,19)(H,18,20)(H,21,22)/p-1/t10-,11-/m0/s1