[1-[8-(2-cyclohexylethanoyloxy)-2-oxidanylidene-1H-quinolin-5-yl]-2-[(phenylmethyl)amino]butyl] cyclohexanecarboxylate

Systemtic Name: [1-[8-(2-cyclohexylethanoyloxy)-2-oxidanylidene-1H-quinolin-5-yl]-2-[(phenylmethyl)amino]butyl] cyclohexanecarboxylate Openeye Name: [2-(benzylamino)-1-[8-(2-cyclohexylacetyl)oxy-2-oxo-1H-quinolin-5-yl]butyl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [1-[8-(2-cyclohexyl-1-oxoethoxy)-2-oxo-1H-quinolin-5-yl]-2-[(phenylmethyl)amino]butyl] ester IUPAC Name: [2-(benzylamino)-1-[8-(2-cyclohexylacetyl)oxy-2-oxo-1H-quinolin-5-yl]butyl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [2-(benzylamino)-1-[8-(2-cyclohexylacetyl)oxy-2-keto-1H-quinolin-5-yl]butyl] ester Formula: C35H44N2O5 MolecularWeight: 572.73426

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=C2C=CC(=O)NC2=C(C=C1)OC(=O)CC3CCCCC3)OC(=O)C4CCCCC4)NCC5=CC=CC=C5

Isomeric SMILES

CCC(C(C1=C2C=CC(=O)NC2=C(C=C1)OC(=O)CC3CCCCC3)OC(=O)C4CCCCC4)NCC5=CC=CC=C5

InChI

InChI=1S/C35H44N2O5/c1-2-29(36-23-25-14-8-4-9-15-25)34(42-35(40)26-16-10-5-11-17-26)28-18-20-30(33-27(28)19-21-31(38)37-33)41-32(39)22-24-12-6-3-7-13-24/h4,8-9,14-15,18-21,24,26,29,34,36H,2-3,5-7,10-13,16-17,22-23H2,1H3,(H,37,38)