ethyl 4-[(4-butoxycarbonylphenyl)amino]-7-chloranyl-8-methyl-quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(4-butoxycarbonylphenyl)amino]-7-chloranyl-8-methyl-quinoline-3-carboxylate Openeye Name: ethyl 4-(4-butoxycarbonylanilino)-7-chloro-8-methyl-quinoline-3-carboxylate CAS Name: 4-[4-[butoxy(oxo)methyl]anilino]-7-chloro-8-methyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-butoxycarbonylanilino)-7-chloro-8-methylquinoline-3-carboxylate Traditional Name: 4-(4-butoxycarbonylanilino)-7-chloro-8-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C24H25ClN2O4 MolecularWeight: 440.9193

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC2=C3C=CC(=C(C3=NC=C2C(=O)OCC)C)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC2=C3C=CC(=C(C3=NC=C2C(=O)OCC)C)Cl

InChI

InChI=1S/C24H25ClN2O4/c1-4-6-13-31-23(28)16-7-9-17(10-8-16)27-22-18-11-12-20(25)15(3)21(18)26-14-19(22)24(29)30-5-2/h7-12,14H,4-6,13H2,1-3H3,(H,26,27)