ethyl 4-[1-[(4-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[(4-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(4-chloro-2-methyl-anilino)-1-methyl-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[1-(4-chloro-2-methylanilino)-1-oxopropan-2-yl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(4-chloro-2-methylanilino)-1-oxopropan-2-yl]piperazine-1-carboxylate Traditional Name: 4-[2-(4-chloro-2-methyl-anilino)-2-keto-1-methyl-ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H24ClN3O3 MolecularWeight: 353.84376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(C)C(=O)NC2=C(C=C(C=C2)Cl)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(C)C(=O)NC2=C(C=C(C=C2)Cl)C

InChI

InChI=1S/C17H24ClN3O3/c1-4-24-17(23)21-9-7-20(8-10-21)13(3)16(22)19-15-6-5-14(18)11-12(15)2/h5-6,11,13H,4,7-10H2,1-3H3,(H,19,22)