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

Systemtic Name: (1S,6S)-6-[(3-chloranyl-4-piperidin-1-ylcarbonyl-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6S)-6-[[3-chloro-4-(piperidine-1-carbonyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-[[3-chloro-4-[oxo(1-piperidinyl)methyl]anilino]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6S)-6-[[3-chloro-4-(piperidine-1-carbonyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-6-[[3-chloro-4-(piperidine-1-carbonyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C20H22ClN2O4- MolecularWeight: 389.85268

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C(C=C(C=C2)NC(=O)C3CC=CCC3C(=O)[O-])Cl

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C(C=C(C=C2)NC(=O)[C@H]3CC=CC[C@@H]3C(=O)[O-])Cl

InChI

InChI=1S/C20H23ClN2O4/c21-17-12-13(8-9-16(17)19(25)23-10-4-1-5-11-23)22-18(24)14-6-2-3-7-15(14)20(26)27/h2-3,8-9,12,14-15H,1,4-7,10-11H2,(H,22,24)(H,26,27)/p-1/t14-,15-/m0/s1