ethyl 6-chloranyl-4-[(4-propoxyphenyl)amino]quinoline-3-carboxylate

Systemtic Name: ethyl 6-chloranyl-4-[(4-propoxyphenyl)amino]quinoline-3-carboxylate Openeye Name: ethyl 6-chloro-4-(4-propoxyanilino)quinoline-3-carboxylate CAS Name: 6-chloro-4-(4-propoxyanilino)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-4-(4-propoxyanilino)quinoline-3-carboxylate Traditional Name: 6-chloro-4-(4-propoxyanilino)quinoline-3-carboxylic acid ethyl ester Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)NC2=C3C=C(C=CC3=NC=C2C(=O)OCC)Cl

Isomeric SMILES

CCCOC1=CC=C(C=C1)NC2=C3C=C(C=CC3=NC=C2C(=O)OCC)Cl

InChI

InChI=1S/C21H21ClN2O3/c1-3-11-27-16-8-6-15(7-9-16)24-20-17-12-14(22)5-10-19(17)23-13-18(20)21(25)26-4-2/h5-10,12-13H,3-4,11H2,1-2H3,(H,23,24)