1-(3-chloranyl-5-ethoxy-4-propoxy-phenyl)carbonyl-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(3-chloranyl-5-ethoxy-4-propoxy-phenyl)carbonyl-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(3-chloro-5-ethoxy-4-propoxy-benzoyl)-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[(3-chloro-5-ethoxy-4-propoxyphenyl)-oxomethyl]-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(3-chloro-5-ethoxy-4-propoxybenzoyl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(3-chloro-5-ethoxy-4-propoxy-benzoyl)-N-(3-pyridylmethyl)isonipecotamide Formula: C24H30ClN3O4 MolecularWeight: 459.9657

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)N2CCC(CC2)C(=O)NCC3=CN=CC=C3)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)N2CCC(CC2)C(=O)NCC3=CN=CC=C3)OCC

InChI

InChI=1S/C24H30ClN3O4/c1-3-12-32-22-20(25)13-19(14-21(22)31-4-2)24(30)28-10-7-18(8-11-28)23(29)27-16-17-6-5-9-26-15-17/h5-6,9,13-15,18H,3-4,7-8,10-12,16H2,1-2H3,(H,27,29)