ethyl 4-[3-(4-bromophenyl)-3-oxidanylidene-propyl]piperazine-1-carboxylate hydrochloride

Systemtic Name: ethyl 4-[3-(4-bromophenyl)-3-oxidanylidene-propyl]piperazine-1-carboxylate hydrochloride Openeye Name: ethyl 4-[3-(4-bromophenyl)-3-oxo-propyl]piperazine-1-carboxylate hydrochloride CAS Name: 4-[3-(4-bromophenyl)-3-oxopropyl]-1-piperazinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[3-(4-bromophenyl)-3-oxopropyl]piperazine-1-carboxylate hydrochloride Traditional Name: 4-[3-(4-bromophenyl)-3-keto-propyl]piperazine-1-carboxylic acid ethyl ester hydrochloride Formula: C16H22BrClN2O3 MolecularWeight: 405.71448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CCC(=O)C2=CC=C(C=C2)Br.Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CCC(=O)C2=CC=C(C=C2)Br.Cl

InChI

InChI=1S/C16H21BrN2O3.ClH/c1-2-22-16(21)19-11-9-18(10-12-19)8-7-15(20)13-3-5-14(17)6-4-13;/h3-6H,2,7-12H2,1H3;1H