methyl 4-(4-azanylpiperidin-1-yl)-3-chloranyl-benzoate

Systemtic Name: methyl 4-(4-azanylpiperidin-1-yl)-3-chloranyl-benzoate Openeye Name: methyl 4-(4-amino-1-piperidyl)-3-chloro-benzoate CAS Name: 4-(4-amino-1-piperidinyl)-3-chlorobenzoic acid methyl ester IUPAC Name: methyl 4-(4-aminopiperidin-1-yl)-3-chlorobenzoate Traditional Name: 4-(4-aminopiperidino)-3-chloro-benzoic acid methyl ester Formula: C13H17ClN2O2 MolecularWeight: 268.73928

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCC(CC2)N)Cl

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCC(CC2)N)Cl

InChI

InChI=1S/C13H17ClN2O2/c1-18-13(17)9-2-3-12(11(14)8-9)16-6-4-10(15)5-7-16/h2-3,8,10H,4-7,15H2,1H3