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

Systemtic Name: methyl 4-chloranyl-2-[[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]carbonylamino]benzoate Openeye Name: methyl 4-chloro-2-[[4-(pyrrolidin-1-ylmethyl)piperidine-1-carbonyl]amino]benzoate CAS Name: 4-chloro-2-[[oxo-[4-(1-pyrrolidinylmethyl)-1-piperidinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[[4-(pyrrolidin-1-ylmethyl)piperidine-1-carbonyl]amino]benzoate Traditional Name: 4-chloro-2-[[4-(pyrrolidinomethyl)piperidine-1-carbonyl]amino]benzoic acid methyl ester Formula: C19H26ClN3O3 MolecularWeight: 379.88104

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)N2CCC(CC2)CN3CCCC3

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)N2CCC(CC2)CN3CCCC3

InChI

InChI=1S/C19H26ClN3O3/c1-26-18(24)16-5-4-15(20)12-17(16)21-19(25)23-10-6-14(7-11-23)13-22-8-2-3-9-22/h4-5,12,14H,2-3,6-11,13H2,1H3,(H,21,25)