(3S)-1-(5-chloranyl-2-methoxy-phenyl)carbonylpiperidine-3-carboxylate

Systemtic Name: (3S)-1-(5-chloranyl-2-methoxy-phenyl)carbonylpiperidine-3-carboxylate Openeye Name: (3S)-1-(5-chloro-2-methoxy-benzoyl)piperidine-3-carboxylate CAS Name: (3S)-1-[(5-chloro-2-methoxyphenyl)-oxomethyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-(5-chloro-2-methoxybenzoyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(5-chloro-2-methoxy-benzoyl)nipecotate Formula: C14H15ClNO4- MolecularWeight: 296.7262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)N2CCCC(C2)C(=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)N2CCC[C@@H](C2)C(=O)[O-]

InChI

InChI=1S/C14H16ClNO4/c1-20-12-5-4-10(15)7-11(12)13(17)16-6-2-3-9(8-16)14(18)19/h4-5,7,9H,2-3,6,8H2,1H3,(H,18,19)/p-1/t9-/m0/s1