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

Systemtic Name: 4-[[2-ethyl-3-(hydroxymethyl)phenyl]amino]-6,7-dimethoxy-quinoline-3-carboxamide Openeye Name: 4-[2-ethyl-3-(hydroxymethyl)anilino]-6,7-dimethoxy-quinoline-3-carboxamide CAS Name: 4-[2-ethyl-3-(hydroxymethyl)anilino]-6,7-dimethoxy-3-quinolinecarboxamide IUPAC Name: 4-[2-ethyl-3-(hydroxymethyl)anilino]-6,7-dimethoxyquinoline-3-carboxamide Traditional Name: 4-(2-ethyl-3-methylol-anilino)-6,7-dimethoxy-quinoline-3-carboxamide Formula: C21H23N3O4 MolecularWeight: 381.42502

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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)CO

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4/c1-4-13-12(11-25)6-5-7-16(13)24-20-14-8-18(27-2)19(28-3)9-17(14)23-10-15(20)21(22)26/h5-10,25H,4,11H2,1-3H3,(H2,22,26)(H,23,24)