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

Systemtic Name: ethyl 1-(2-cyclohexylethyl)-4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-(2-cyclohexylethyl)-4-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxo-quinoline-3-carboxylate CAS Name: 1-(2-cyclohexylethyl)-4-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-2-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-cyclohexylethyl)-4-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoquinoline-3-carboxylate Traditional Name: 1-(2-cyclohexylethyl)-4-[4-(2-furoyl)piperazino]-2-keto-quinoline-3-carboxylic acid ethyl ester Formula: C29H35N3O5 MolecularWeight: 505.6053

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N(C1=O)CCC3CCCCC3)N4CCN(CC4)C(=O)C5=CC=CO5

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N(C1=O)CCC3CCCCC3)N4CCN(CC4)C(=O)C5=CC=CO5

InChI

InChI=1S/C29H35N3O5/c1-2-36-29(35)25-26(30-16-18-31(19-17-30)27(33)24-13-8-20-37-24)22-11-6-7-12-23(22)32(28(25)34)15-14-21-9-4-3-5-10-21/h6-8,11-13,20-21H,2-5,9-10,14-19H2,1H3