ethyl 2-(2-azanylethoxymethyl)-4-(2-cyanophenyl)-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 2-(2-azanylethoxymethyl)-4-(2-cyanophenyl)-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: ethyl 2-(2-aminoethoxymethyl)-4-(2-cyanophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 2-(2-aminoethoxymethyl)-4-(2-cyanophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-aminoethoxymethyl)-4-(2-cyanophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 2-(2-aminoethoxymethyl)-4-(2-cyanophenyl)-5-keto-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid ethyl ester Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3C#N)C(=O)CCC2)COCCN

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3C#N)C(=O)CCC2)COCCN

InChI

InChI=1S/C22H25N3O4/c1-2-29-22(27)21-17(13-28-11-10-23)25-16-8-5-9-18(26)20(16)19(21)15-7-4-3-6-14(15)12-24/h3-4,6-7,19,25H,2,5,8-11,13,23H2,1H3