[2-[(2,3-dimethylcyclohexyl)amino]-2-oxidanylidene-ethyl] 3-(3,4-dimethylphenyl)adamantane-1-carboxylate

Systemtic Name: [2-[(2,3-dimethylcyclohexyl)amino]-2-oxidanylidene-ethyl] 3-(3,4-dimethylphenyl)adamantane-1-carboxylate Openeye Name: [2-[(2,3-dimethylcyclohexyl)amino]-2-oxo-ethyl] 3-(3,4-dimethylphenyl)adamantane-1-carboxylate CAS Name: 3-(3,4-dimethylphenyl)-1-adamantanecarboxylic acid [2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl] 3-(3,4-dimethylphenyl)adamantane-1-carboxylate Traditional Name: 3-(3,4-dimethylphenyl)adamantane-1-carboxylic acid [2-[(2,3-dimethylcyclohexyl)amino]-2-keto-ethyl] ester Formula: C29H41NO3 MolecularWeight: 451.64074

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)C5=CC(=C(C=C5)C)C

Isomeric SMILES

CC1CCCC(C1C)NC(=O)COC(=O)C23CC4CC(C2)CC(C4)(C3)C5=CC(=C(C=C5)C)C

InChI

InChI=1S/C29H41NO3/c1-18-8-9-24(10-20(18)3)28-12-22-11-23(13-28)15-29(14-22,17-28)27(32)33-16-26(31)30-25-7-5-6-19(2)21(25)4/h8-10,19,21-23,25H,5-7,11-17H2,1-4H3,(H,30,31)