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

Systemtic Name: (1S,6R)-6-[[(4-cyclopentyloxyphenyl)carbonylamino]carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6R)-6-[[[4-(cyclopentoxy)benzoyl]amino]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-6-[[[(4-cyclopentyloxyphenyl)-oxomethyl]hydrazo]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6R)-6-[[(4-cyclopentyloxybenzoyl)amino]carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-6-[[[4-(cyclopentoxy)benzoyl]amino]carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C20H23N2O5- MolecularWeight: 371.40702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=CC=C(C=C2)C(=O)NNC(=O)C3CC=CCC3C(=O)[O-]

Isomeric SMILES

C1CCC(C1)OC2=CC=C(C=C2)C(=O)NNC(=O)[C@@H]3CC=CC[C@@H]3C(=O)[O-]

InChI

InChI=1S/C20H24N2O5/c23-18(13-9-11-15(12-10-13)27-14-5-1-2-6-14)21-22-19(24)16-7-3-4-8-17(16)20(25)26/h3-4,9-12,14,16-17H,1-2,5-8H2,(H,21,23)(H,22,24)(H,25,26)/p-1/t16-,17+/m1/s1