1-chloroethyl 4-(4-methanoyl-2,5-dimethyl-phenyl)piperazine-1-carboxylate

Systemtic Name: 1-chloroethyl 4-(4-methanoyl-2,5-dimethyl-phenyl)piperazine-1-carboxylate Openeye Name: 1-chloroethyl 4-(4-formyl-2,5-dimethyl-phenyl)piperazine-1-carboxylate CAS Name: 4-(4-formyl-2,5-dimethylphenyl)-1-piperazinecarboxylic acid 1-chloroethyl ester IUPAC Name: 1-chloroethyl 4-(4-formyl-2,5-dimethylphenyl)piperazine-1-carboxylate Traditional Name: 4-(4-formyl-2,5-dimethyl-phenyl)piperazine-1-carboxylic acid 1-chloroethyl ester Formula: C16H21ClN2O3 MolecularWeight: 324.80254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C=O)C)N2CCN(CC2)C(=O)OC(C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1C=O)C)N2CCN(CC2)C(=O)OC(C)Cl

InChI

InChI=1S/C16H21ClN2O3/c1-11-9-15(12(2)8-14(11)10-20)18-4-6-19(7-5-18)16(21)22-13(3)17/h8-10,13H,4-7H2,1-3H3