[2-[[2,6-bis(chloranyl)-4-ethanoyl-phenyl]amino]-2-oxidanylidene-ethyl] 3-methylpiperazine-1-carboxylate

Systemtic Name: [2-[[2,6-bis(chloranyl)-4-ethanoyl-phenyl]amino]-2-oxidanylidene-ethyl] 3-methylpiperazine-1-carboxylate Openeye Name: [2-(4-acetyl-2,6-dichloro-anilino)-2-oxo-ethyl] 3-methylpiperazine-1-carboxylate CAS Name: 3-methyl-1-piperazinecarboxylic acid [2-(4-acetyl-2,6-dichloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-acetyl-2,6-dichloroanilino)-2-oxoethyl] 3-methylpiperazine-1-carboxylate Traditional Name: 3-methylpiperazine-1-carboxylic acid [2-(4-acetyl-2,6-dichloro-anilino)-2-keto-ethyl] ester Formula: C16H19Cl2N3O4 MolecularWeight: 388.24576

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C(=O)OCC(=O)NC2=C(C=C(C=C2Cl)C(=O)C)Cl

Isomeric SMILES

CC1CN(CCN1)C(=O)OCC(=O)NC2=C(C=C(C=C2Cl)C(=O)C)Cl

InChI

InChI=1S/C16H19Cl2N3O4/c1-9-7-21(4-3-19-9)16(24)25-8-14(23)20-15-12(17)5-11(10(2)22)6-13(15)18/h5-6,9,19H,3-4,7-8H2,1-2H3,(H,20,23)