ethanenitrile; 2-ethyl-N-(4-methoxyphenyl)-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: ethanenitrile; 2-ethyl-N-(4-methoxyphenyl)-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: acetonitrile; 2-ethyl-N-(4-methoxyphenyl)-4-oxo-1H-quinoline-3-carboxamide CAS Name: acetonitrile; 2-ethyl-N-(4-methoxyphenyl)-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: acetonitrile; 2-ethyl-N-(4-methoxyphenyl)-4-oxo-1H-quinoline-3-carboxamide Traditional Name: acetonitrile; 2-ethyl-4-keto-N-(4-methoxyphenyl)-1H-quinoline-3-carboxamide Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C2=CC=CC=C2N1)C(=O)NC3=CC=C(C=C3)OC.CC#N

Isomeric SMILES

CCC1=C(C(=O)C2=CC=CC=C2N1)C(=O)NC3=CC=C(C=C3)OC.CC#N

InChI

InChI=1S/C19H18N2O3.C2H3N/c1-3-15-17(18(22)14-6-4-5-7-16(14)21-15)19(23)20-12-8-10-13(24-2)11-9-12;1-2-3/h4-11H,3H2,1-2H3,(H,20,23)(H,21,22);1H3