(1S,6S)-6-[[4-(4-chloranylphenoxy)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6S)-6-[[4-(4-chloranylphenoxy)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6S)-6-[[4-(4-chlorophenoxy)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-[[4-(4-chlorophenoxy)anilino]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6S)-6-[[4-(4-chlorophenoxy)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-6-[[4-(4-chlorophenoxy)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C20H17ClNO4- MolecularWeight: 370.80628

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)Cl)C(=O)[O-]

Isomeric SMILES

C1C=CC[C@@H]([C@H]1C(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)Cl)C(=O)[O-]

InChI

InChI=1S/C20H18ClNO4/c21-13-5-9-15(10-6-13)26-16-11-7-14(8-12-16)22-19(23)17-3-1-2-4-18(17)20(24)25/h1-2,5-12,17-18H,3-4H2,(H,22,23)(H,24,25)/p-1/t17-,18-/m0/s1