4-[[3-(aminomethyl)-2-ethyl-phenyl]amino]-6,7-diethoxy-quinoline-3-carboxamide

Systemtic Name: 4-[[3-(aminomethyl)-2-ethyl-phenyl]amino]-6,7-diethoxy-quinoline-3-carboxamide Openeye Name: 4-[3-(aminomethyl)-2-ethyl-anilino]-6,7-diethoxy-quinoline-3-carboxamide CAS Name: 4-[3-(aminomethyl)-2-ethylanilino]-6,7-diethoxy-3-quinolinecarboxamide IUPAC Name: 4-[3-(aminomethyl)-2-ethylanilino]-6,7-diethoxyquinoline-3-carboxamide Traditional Name: 4-[3-(aminomethyl)-2-ethyl-anilino]-6,7-diethoxy-quinoline-3-carboxamide Formula: C23H28N4O3 MolecularWeight: 408.49342

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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)CN

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O3/c1-4-15-14(12-24)8-7-9-18(15)27-22-16-10-20(29-5-2)21(30-6-3)11-19(16)26-13-17(22)23(25)28/h7-11,13H,4-6,12,24H2,1-3H3,(H2,25,28)(H,26,27)