ethyl 4-(2-oxidanylpropylamino)-6-phenoxy-quinoline-3-carboxylate

Systemtic Name: ethyl 4-(2-oxidanylpropylamino)-6-phenoxy-quinoline-3-carboxylate Openeye Name: ethyl 4-(2-hydroxypropylamino)-6-phenoxy-quinoline-3-carboxylate CAS Name: 4-(2-hydroxypropylamino)-6-phenoxy-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-hydroxypropylamino)-6-phenoxyquinoline-3-carboxylate Traditional Name: 4-(2-hydroxypropylamino)-6-phenoxy-quinoline-3-carboxylic acid ethyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NCC(C)O)OC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NCC(C)O)OC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4/c1-3-26-21(25)18-13-22-19-10-9-16(27-15-7-5-4-6-8-15)11-17(19)20(18)23-12-14(2)24/h4-11,13-14,24H,3,12H2,1-2H3,(H,22,23)