methyl 4-chloranyl-2-[[4-[(4-methylpiperidin-1-yl)methyl]piperidin-1-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-chloranyl-2-[[4-[(4-methylpiperidin-1-yl)methyl]piperidin-1-yl]carbonylamino]benzoate Openeye Name: methyl 4-chloro-2-[[4-[(4-methyl-1-piperidyl)methyl]piperidine-1-carbonyl]amino]benzoate CAS Name: 4-chloro-2-[[[4-[(4-methyl-1-piperidinyl)methyl]-1-piperidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[[4-[(4-methylpiperidin-1-yl)methyl]piperidine-1-carbonyl]amino]benzoate Traditional Name: 4-chloro-2-[[4-[(4-methylpiperidino)methyl]piperidine-1-carbonyl]amino]benzoic acid methyl ester Formula: C21H30ClN3O3 MolecularWeight: 407.9342

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC2CCN(CC2)C(=O)NC3=C(C=CC(=C3)Cl)C(=O)OC

Isomeric SMILES

CC1CCN(CC1)CC2CCN(CC2)C(=O)NC3=C(C=CC(=C3)Cl)C(=O)OC

InChI

InChI=1S/C21H30ClN3O3/c1-15-5-9-24(10-6-15)14-16-7-11-25(12-8-16)21(27)23-19-13-17(22)3-4-18(19)20(26)28-2/h3-4,13,15-16H,5-12,14H2,1-2H3,(H,23,27)