[2-(cyclohexylamino)-1-(4-methylphenyl)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate

Systemtic Name: [2-(cyclohexylamino)-1-(4-methylphenyl)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate Openeye Name: [2-(cyclohexylamino)-2-oxo-1-(p-tolyl)ethyl] 2H-chromene-3-carboxylate CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(cyclohexylamino)-1-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylamino)-1-(4-methylphenyl)-2-oxoethyl] 2H-chromene-3-carboxylate Traditional Name: 2H-chromene-3-carboxylic acid [2-(cyclohexylamino)-2-keto-1-(p-tolyl)ethyl] ester Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)NC2CCCCC2)OC(=O)C3=CC4=CC=CC=C4OC3

Isomeric SMILES

CC1=CC=C(C=C1)C(C(=O)NC2CCCCC2)OC(=O)C3=CC4=CC=CC=C4OC3

InChI

InChI=1S/C25H27NO4/c1-17-11-13-18(14-12-17)23(24(27)26-21-8-3-2-4-9-21)30-25(28)20-15-19-7-5-6-10-22(19)29-16-20/h5-7,10-15,21,23H,2-4,8-9,16H2,1H3,(H,26,27)