6,7-diethoxy-4-[[2-ethyl-3-[[2-(hydroxymethyl)piperidin-1-yl]methyl]phenyl]amino]quinoline-3-carboxamide

Systemtic Name: 6,7-diethoxy-4-[[2-ethyl-3-[[2-(hydroxymethyl)piperidin-1-yl]methyl]phenyl]amino]quinoline-3-carboxamide Openeye Name: 6,7-diethoxy-4-[2-ethyl-3-[[2-(hydroxymethyl)-1-piperidyl]methyl]anilino]quinoline-3-carboxamide CAS Name: 6,7-diethoxy-4-[2-ethyl-3-[[2-(hydroxymethyl)-1-piperidinyl]methyl]anilino]-3-quinolinecarboxamide IUPAC Name: 6,7-diethoxy-4-[2-ethyl-3-[[2-(hydroxymethyl)piperidin-1-yl]methyl]anilino]quinoline-3-carboxamide Traditional Name: 6,7-diethoxy-4-[2-ethyl-3-[(2-methylolpiperidino)methyl]anilino]quinoline-3-carboxamide Formula: C29H38N4O4 MolecularWeight: 506.63642

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC=C1NC2=C(C=NC3=CC(=C(C=C32)OCC)OCC)C(=O)N)CN4CCCCC4CO

Isomeric SMILES

CCC1=C(C=CC=C1NC2=C(C=NC3=CC(=C(C=C32)OCC)OCC)C(=O)N)CN4CCCCC4CO

InChI

InChI=1S/C29H38N4O4/c1-4-21-19(17-33-13-8-7-11-20(33)18-34)10-9-12-24(21)32-28-22-14-26(36-5-2)27(37-6-3)15-25(22)31-16-23(28)29(30)35/h9-10,12,14-16,20,34H,4-8,11,13,17-18H2,1-3H3,(H2,30,35)(H,31,32)