[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 4-butylcyclohexane-1-carboxylate

Systemtic Name: [2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 4-butylcyclohexane-1-carboxylate Openeye Name: [2-(2,6-dimethylanilino)-2-oxo-ethyl] 4-butylcyclohexanecarboxylate CAS Name: 4-butyl-1-cyclohexanecarboxylic acid [2-(2,6-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dimethylanilino)-2-oxoethyl] 4-butylcyclohexane-1-carboxylate Traditional Name: 4-butylcyclohexanecarboxylic acid [2-(2,6-dimethylanilino)-2-keto-ethyl] ester Formula: C21H31NO3 MolecularWeight: 345.47574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)OCC(=O)NC2=C(C=CC=C2C)C

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)OCC(=O)NC2=C(C=CC=C2C)C

InChI

InChI=1S/C21H31NO3/c1-4-5-9-17-10-12-18(13-11-17)21(24)25-14-19(23)22-20-15(2)7-6-8-16(20)3/h6-8,17-18H,4-5,9-14H2,1-3H3,(H,22,23)