methyl 4-[[[1-(5-chloranyl-2-methoxy-phenyl)carbonylpiperidin-4-yl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[1-(5-chloranyl-2-methoxy-phenyl)carbonylpiperidin-4-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[1-(5-chloro-2-methoxy-benzoyl)piperidine-4-carbonyl]amino]methyl]benzoate CAS Name: 4-[[[[1-[(5-chloro-2-methoxyphenyl)-oxomethyl]-4-piperidinyl]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[1-(5-chloro-2-methoxybenzoyl)piperidine-4-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[[1-(5-chloro-2-methoxy-benzoyl)isonipecotoyl]amino]methyl]benzoic acid methyl ester Formula: C23H25ClN2O5 MolecularWeight: 444.908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H25ClN2O5/c1-30-20-8-7-18(24)13-19(20)22(28)26-11-9-16(10-12-26)21(27)25-14-15-3-5-17(6-4-15)23(29)31-2/h3-8,13,16H,9-12,14H2,1-2H3,(H,25,27)