methyl 4-chloranyl-3-piperidin-1-yl-benzoate

Systemtic Name: methyl 4-chloranyl-3-piperidin-1-yl-benzoate Openeye Name: methyl 4-chloro-3-(1-piperidyl)benzoate CAS Name: 4-chloro-3-(1-piperidinyl)benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-piperidin-1-ylbenzoate Traditional Name: 4-chloro-3-piperidino-benzoic acid methyl ester Formula: C13H16ClNO2 MolecularWeight: 253.72464

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)N2CCCCC2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)N2CCCCC2

InChI

InChI=1S/C13H16ClNO2/c1-17-13(16)10-5-6-11(14)12(9-10)15-7-3-2-4-8-15/h5-6,9H,2-4,7-8H2,1H3