N-[2-[1-(2,6-dimethoxy-4-methyl-phenyl)pentylamino]-2-oxidanylidene-ethyl]quinoline-3-carboxamide

Systemtic Name: N-[2-[1-(2,6-dimethoxy-4-methyl-phenyl)pentylamino]-2-oxidanylidene-ethyl]quinoline-3-carboxamide Openeye Name: N-[2-[1-(2,6-dimethoxy-4-methyl-phenyl)pentylamino]-2-oxo-ethyl]quinoline-3-carboxamide CAS Name: N-[2-[1-(2,6-dimethoxy-4-methylphenyl)pentylamino]-2-oxoethyl]-3-quinolinecarboxamide IUPAC Name: N-[2-[1-(2,6-dimethoxy-4-methylphenyl)pentylamino]-2-oxoethyl]quinoline-3-carboxamide Traditional Name: N-[2-[1-(2,6-dimethoxy-4-methyl-phenyl)pentylamino]-2-keto-ethyl]quinoline-3-carboxamide Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=C(C=C(C=C1OC)C)OC)NC(=O)CNC(=O)C2=CC3=CC=CC=C3N=C2

Isomeric SMILES

CCCCC(C1=C(C=C(C=C1OC)C)OC)NC(=O)CNC(=O)C2=CC3=CC=CC=C3N=C2

InChI

InChI=1S/C26H31N3O4/c1-5-6-10-21(25-22(32-3)12-17(2)13-23(25)33-4)29-24(30)16-28-26(31)19-14-18-9-7-8-11-20(18)27-15-19/h7-9,11-15,21H,5-6,10,16H2,1-4H3,(H,28,31)(H,29,30)