(1S,6R)-6-[[3-(cyclopropylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6R)-6-[[3-(cyclopropylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6R)-6-[[3-(cyclopropylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-6-[[3-[(cyclopropylamino)-oxomethyl]anilino]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6R)-6-[[3-(cyclopropylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-6-[[3-(cyclopropylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C18H19N2O4- MolecularWeight: 327.35446

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)C3CC=CCC3C(=O)[O-]

Isomeric SMILES

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)[O-]

InChI

InChI=1S/C18H20N2O4/c21-16(19-12-8-9-12)11-4-3-5-13(10-11)20-17(22)14-6-1-2-7-15(14)18(23)24/h1-5,10,12,14-15H,6-9H2,(H,19,21)(H,20,22)(H,23,24)/p-1/t14-,15+/m1/s1