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

Systemtic Name: 4-[[3-[(4-aminocarbonylpiperidin-1-yl)methyl]-2-ethyl-phenyl]amino]-6,7-diethoxy-quinoline-3-carboxamide Openeye Name: 4-[3-[(4-carbamoyl-1-piperidyl)methyl]-2-ethyl-anilino]-6,7-diethoxy-quinoline-3-carboxamide CAS Name: 4-[3-[(4-carbamoyl-1-piperidinyl)methyl]-2-ethylanilino]-6,7-diethoxy-3-quinolinecarboxamide IUPAC Name: 4-[3-[(4-carbamoylpiperidin-1-yl)methyl]-2-ethylanilino]-6,7-diethoxyquinoline-3-carboxamide Traditional Name: 4-[3-[(4-carbamoylpiperidino)methyl]-2-ethyl-anilino]-6,7-diethoxy-quinoline-3-carboxamide Formula: C29H37N5O4 MolecularWeight: 519.63518

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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)CN4CCC(CC4)C(=O)N

Isomeric SMILES

CCC1=C(C=CC=C1NC2=C(C=NC3=CC(=C(C=C32)OCC)OCC)C(=O)N)CN4CCC(CC4)C(=O)N

InChI

InChI=1S/C29H37N5O4/c1-4-20-19(17-34-12-10-18(11-13-34)28(30)35)8-7-9-23(20)33-27-21-14-25(37-5-2)26(38-6-3)15-24(21)32-16-22(27)29(31)36/h7-9,14-16,18H,4-6,10-13,17H2,1-3H3,(H2,30,35)(H2,31,36)(H,32,33)