(1R,6R)-6-[(5-chloranyl-2-methoxycarbonyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6R)-6-[(5-chloranyl-2-methoxycarbonyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6R)-6-[(5-chloro-2-methoxycarbonyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1R,6R)-6-[(5-chloro-2-methoxycarbonylanilino)-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6R)-6-[(5-chloro-2-methoxycarbonylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1R,6R)-6-[(2-carbomethoxy-5-chloro-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C16H15ClNO5- MolecularWeight: 336.747

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)C2CC=CCC2C(=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)[C@@H]2CC=CC[C@H]2C(=O)[O-]

InChI

InChI=1S/C16H16ClNO5/c1-23-16(22)12-7-6-9(17)8-13(12)18-14(19)10-4-2-3-5-11(10)15(20)21/h2-3,6-8,10-11H,4-5H2,1H3,(H,18,19)(H,20,21)/p-1/t10-,11-/m1/s1