methyl 2-chloranyl-5-[(1-prop-2-ynylpiperidin-4-yl)amino]benzoate

Systemtic Name: methyl 2-chloranyl-5-[(1-prop-2-ynylpiperidin-4-yl)amino]benzoate Openeye Name: methyl 2-chloro-5-[(1-prop-2-ynyl-4-piperidyl)amino]benzoate CAS Name: 2-chloro-5-[(1-prop-2-ynyl-4-piperidinyl)amino]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[(1-prop-2-ynylpiperidin-4-yl)amino]benzoate Traditional Name: 2-chloro-5-[(1-propargyl-4-piperidyl)amino]benzoic acid methyl ester Formula: C16H19ClN2O2 MolecularWeight: 306.78726

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)NC2CCN(CC2)CC#C)Cl

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)NC2CCN(CC2)CC#C)Cl

InChI

InChI=1S/C16H19ClN2O2/c1-3-8-19-9-6-12(7-10-19)18-13-4-5-15(17)14(11-13)16(20)21-2/h1,4-5,11-12,18H,6-10H2,2H3