[1-[[2,3-bis(chloranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 4-azanylquinoline-3-carboxylate

Systemtic Name: [1-[[2,3-bis(chloranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 4-azanylquinoline-3-carboxylate Openeye Name: [2-(2,3-dichloroanilino)-1-methyl-2-oxo-ethyl] 4-aminoquinoline-3-carboxylate CAS Name: 4-amino-3-quinolinecarboxylic acid [1-(2,3-dichloroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,3-dichloroanilino)-1-oxopropan-2-yl] 4-aminoquinoline-3-carboxylate Traditional Name: 4-aminoquinoline-3-carboxylic acid [2-(2,3-dichloroanilino)-2-keto-1-methyl-ethyl] ester Formula: C19H15Cl2N3O3 MolecularWeight: 404.2467

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C(=CC=C1)Cl)Cl)OC(=O)C2=C(C3=CC=CC=C3N=C2)N

Isomeric SMILES

CC(C(=O)NC1=C(C(=CC=C1)Cl)Cl)OC(=O)C2=C(C3=CC=CC=C3N=C2)N

InChI

InChI=1S/C19H15Cl2N3O3/c1-10(18(25)24-15-8-4-6-13(20)16(15)21)27-19(26)12-9-23-14-7-3-2-5-11(14)17(12)22/h2-10H,1H3,(H2,22,23)(H,24,25)