2-[[(2-methylphenyl)carbonyl-(quinolin-4-ylmethoxy)amino]methyl]-1-propyl-piperidine-4-carboxamide

Systemtic Name: 2-[[(2-methylphenyl)carbonyl-(quinolin-4-ylmethoxy)amino]methyl]-1-propyl-piperidine-4-carboxamide Openeye Name: 2-[[(2-methylbenzoyl)-(4-quinolylmethoxy)amino]methyl]-1-propyl-piperidine-4-carboxamide CAS Name: 2-[[[(2-methylphenyl)-oxomethyl]-(4-quinolinylmethoxy)amino]methyl]-1-propyl-4-piperidinecarboxamide IUPAC Name: 2-[[(2-methylbenzoyl)-(quinolin-4-ylmethoxy)amino]methyl]-1-propylpiperidine-4-carboxamide Traditional Name: 2-[[o-toluoyl(4-quinolylmethoxy)amino]methyl]-1-propyl-isonipecotamide Formula: C28H34N4O3 MolecularWeight: 474.59456

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1CN(C(=O)C2=CC=CC=C2C)OCC3=CC=NC4=CC=CC=C34)C(=O)N

Isomeric SMILES

CCCN1CCC(CC1CN(C(=O)C2=CC=CC=C2C)OCC3=CC=NC4=CC=CC=C34)C(=O)N

InChI

InChI=1S/C28H34N4O3/c1-3-15-31-16-13-21(27(29)33)17-23(31)18-32(28(34)24-9-5-4-8-20(24)2)35-19-22-12-14-30-26-11-7-6-10-25(22)26/h4-12,14,21,23H,3,13,15-19H2,1-2H3,(H2,29,33)