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

Systemtic Name: ethyl 1-(cyclohexylmethyl)-4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-(cyclohexylmethyl)-4-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxo-quinoline-3-carboxylate CAS Name: 1-(cyclohexylmethyl)-4-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-2-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(cyclohexylmethyl)-4-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoquinoline-3-carboxylate Traditional Name: 1-(cyclohexylmethyl)-4-[4-(2-furoyl)piperazino]-2-keto-quinoline-3-carboxylic acid ethyl ester Formula: C28H33N3O5 MolecularWeight: 491.57872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N(C1=O)CC3CCCCC3)N4CCN(CC4)C(=O)C5=CC=CO5

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N(C1=O)CC3CCCCC3)N4CCN(CC4)C(=O)C5=CC=CO5

InChI

InChI=1S/C28H33N3O5/c1-2-35-28(34)24-25(29-14-16-30(17-15-29)26(32)23-13-8-18-36-23)21-11-6-7-12-22(21)31(27(24)33)19-20-9-4-3-5-10-20/h6-8,11-13,18,20H,2-5,9-10,14-17,19H2,1H3