N'-(3-chloranyl-4-methoxy-phenyl)-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]ethanediamide

Systemtic Name: N'-(3-chloranyl-4-methoxy-phenyl)-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]ethanediamide Openeye Name: N'-(3-chloro-4-methoxy-phenyl)-N-[[1-(4-pyridylmethyl)-4-piperidyl]methyl]oxamide CAS Name: N'-(3-chloro-4-methoxyphenyl)-N-[[1-(pyridin-4-ylmethyl)-4-piperidinyl]methyl]oxamide IUPAC Name: N'-(3-chloro-4-methoxyphenyl)-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]oxamide Traditional Name: N'-(3-chloro-4-methoxy-phenyl)-N-[[1-(4-pyridylmethyl)-4-piperidyl]methyl]oxamide Formula: C21H25ClN4O3 MolecularWeight: 416.9012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C(=O)NCC2CCN(CC2)CC3=CC=NC=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C(=O)NCC2CCN(CC2)CC3=CC=NC=C3)Cl

InChI

InChI=1S/C21H25ClN4O3/c1-29-19-3-2-17(12-18(19)22)25-21(28)20(27)24-13-15-6-10-26(11-7-15)14-16-4-8-23-9-5-16/h2-5,8-9,12,15H,6-7,10-11,13-14H2,1H3,(H,24,27)(H,25,28)