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

Systemtic Name: ethyl 4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6-methyl-1-(4-methylpentyl)-2-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 4-[4-(furan-2-carbonyl)piperazin-1-yl]-1-isohexyl-6-methyl-2-oxo-quinoline-3-carboxylate CAS Name: 4-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-6-methyl-1-(4-methylpentyl)-2-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(furan-2-carbonyl)piperazin-1-yl]-6-methyl-1-(4-methylpentyl)-2-oxoquinoline-3-carboxylate Traditional Name: 4-[4-(2-furoyl)piperazino]-1-isohexyl-2-keto-6-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C28H35N3O5 MolecularWeight: 493.5946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H35N3O5/c1-5-35-28(34)24-25(29-13-15-30(16-14-29)26(32)23-9-7-17-36-23)21-18-20(4)10-11-22(21)31(27(24)33)12-6-8-19(2)3/h7,9-11,17-19H,5-6,8,12-16H2,1-4H3