[2-[(4-butoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl] 2-(2,4-dichlorophenyl)quinoline-4-carboxylate

Systemtic Name: [2-[(4-butoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl] 2-(2,4-dichlorophenyl)quinoline-4-carboxylate Openeye Name: [2-(4-butoxycarbonylanilino)-2-oxo-ethyl] 2-(2,4-dichlorophenyl)quinoline-4-carboxylate CAS Name: 2-(2,4-dichlorophenyl)-4-quinolinecarboxylic acid [2-[4-[butoxy(oxo)methyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-butoxycarbonylanilino)-2-oxoethyl] 2-(2,4-dichlorophenyl)quinoline-4-carboxylate Traditional Name: 2-(2,4-dichlorophenyl)cinchoninic acid [2-(4-butoxycarbonylanilino)-2-keto-ethyl] ester Formula: C29H24Cl2N2O5 MolecularWeight: 551.41726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C29H24Cl2N2O5/c1-2-3-14-37-28(35)18-8-11-20(12-9-18)32-27(34)17-38-29(36)23-16-26(22-13-10-19(30)15-24(22)31)33-25-7-5-4-6-21(23)25/h4-13,15-16H,2-3,14,17H2,1H3,(H,32,34)