ethyl 6-chloranyl-4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-methyl-2-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 6-chloranyl-4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-methyl-2-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 6-chloro-4-[4-(furan-2-carbonyl)piperazin-1-yl]-1-methyl-2-oxo-quinoline-3-carboxylate CAS Name: 6-chloro-4-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-1-methyl-2-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-4-[4-(furan-2-carbonyl)piperazin-1-yl]-1-methyl-2-oxoquinoline-3-carboxylate Traditional Name: 6-chloro-4-[4-(2-furoyl)piperazino]-2-keto-1-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C22H22ClN3O5 MolecularWeight: 443.88018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC(=C2)Cl)N(C1=O)C)N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC(=C2)Cl)N(C1=O)C)N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C22H22ClN3O5/c1-3-30-22(29)18-19(15-13-14(23)6-7-16(15)24(2)21(18)28)25-8-10-26(11-9-25)20(27)17-5-4-12-31-17/h4-7,12-13H,3,8-11H2,1-2H3