[1-[ethyl(phenyl)amino]-1-oxidanylidene-propan-2-yl] 3-chloranyladamantane-1-carboxylate

Systemtic Name: [1-[ethyl(phenyl)amino]-1-oxidanylidene-propan-2-yl] 3-chloranyladamantane-1-carboxylate Openeye Name: [2-(N-ethylanilino)-1-methyl-2-oxo-ethyl] 3-chloroadamantane-1-carboxylate CAS Name: 3-chloro-1-adamantanecarboxylic acid [1-(N-ethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(N-ethylanilino)-1-oxopropan-2-yl] 3-chloroadamantane-1-carboxylate Traditional Name: 3-chloroadamantane-1-carboxylic acid [2-(N-ethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H28ClNO3 MolecularWeight: 389.91562

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C(C)OC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C(C)OC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

InChI

InChI=1S/C22H28ClNO3/c1-3-24(18-7-5-4-6-8-18)19(25)15(2)27-20(26)21-10-16-9-17(11-21)13-22(23,12-16)14-21/h4-8,15-17H,3,9-14H2,1-2H3