(1R,6R)-6-[[2-(cyclohexylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6R)-6-[[2-(cyclohexylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6R)-6-[[2-(cyclohexylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1R,6R)-6-[[2-[(cyclohexylamino)-oxomethyl]anilino]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6R)-6-[[2-(cyclohexylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1R,6R)-6-[[2-(cyclohexylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C21H25N2O4- MolecularWeight: 369.4342

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC=CC=C2NC(=O)C3CC=CCC3C(=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC=CC=C2NC(=O)[C@@H]3CC=CC[C@H]3C(=O)[O-]

InChI

InChI=1S/C21H26N2O4/c24-19(15-10-4-5-11-16(15)21(26)27)23-18-13-7-6-12-17(18)20(25)22-14-8-2-1-3-9-14/h4-7,12-16H,1-3,8-11H2,(H,22,25)(H,23,24)(H,26,27)/p-1/t15-,16-/m1/s1