4-[[2-ethyl-3-[[(phenylmethyl)amino]methyl]phenyl]amino]-6,7-dimethoxy-quinoline-3-carboxamide

Systemtic Name: 4-[[2-ethyl-3-[[(phenylmethyl)amino]methyl]phenyl]amino]-6,7-dimethoxy-quinoline-3-carboxamide Openeye Name: 4-[3-[(benzylamino)methyl]-2-ethyl-anilino]-6,7-dimethoxy-quinoline-3-carboxamide CAS Name: 4-[2-ethyl-3-[[(phenylmethyl)amino]methyl]anilino]-6,7-dimethoxy-3-quinolinecarboxamide IUPAC Name: 4-[3-[(benzylamino)methyl]-2-ethylanilino]-6,7-dimethoxyquinoline-3-carboxamide Traditional Name: 4-[3-[(benzylamino)methyl]-2-ethyl-anilino]-6,7-dimethoxy-quinoline-3-carboxamide Formula: C28H30N4O3 MolecularWeight: 470.5628

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC=C1NC2=C(C=NC3=CC(=C(C=C32)OC)OC)C(=O)N)CNCC4=CC=CC=C4

Isomeric SMILES

CCC1=C(C=CC=C1NC2=C(C=NC3=CC(=C(C=C32)OC)OC)C(=O)N)CNCC4=CC=CC=C4

InChI

InChI=1S/C28H30N4O3/c1-4-20-19(16-30-15-18-9-6-5-7-10-18)11-8-12-23(20)32-27-21-13-25(34-2)26(35-3)14-24(21)31-17-22(27)28(29)33/h5-14,17,30H,4,15-16H2,1-3H3,(H2,29,33)(H,31,32)