[2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 4-butylcyclohexane-1-carboxylate

Systemtic Name: [2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 4-butylcyclohexane-1-carboxylate Openeye Name: [2-(2,5-dimethoxyanilino)-2-oxo-ethyl] 4-butylcyclohexanecarboxylate CAS Name: 4-butyl-1-cyclohexanecarboxylic acid [2-(2,5-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethoxyanilino)-2-oxoethyl] 4-butylcyclohexane-1-carboxylate Traditional Name: 4-butylcyclohexanecarboxylic acid [2-(2,5-dimethoxyanilino)-2-keto-ethyl] ester Formula: C21H31NO5 MolecularWeight: 377.47454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)OCC(=O)NC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)OCC(=O)NC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C21H31NO5/c1-4-5-6-15-7-9-16(10-8-15)21(24)27-14-20(23)22-18-13-17(25-2)11-12-19(18)26-3/h11-13,15-16H,4-10,14H2,1-3H3,(H,22,23)