[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl] quinoxaline-2-carboxylate

Systemtic Name: [2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl] quinoxaline-2-carboxylate Openeye Name: [2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl] quinoxaline-2-carboxylate CAS Name: 2-quinoxalinecarboxylic acid [2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl] quinoxaline-2-carboxylate Traditional Name: quinoxaline-2-carboxylic acid [2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl] ester Formula: C21H19ClN4O3 MolecularWeight: 410.85356

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)COC(=O)C3=NC4=CC=CC=C4N=C3

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)COC(=O)C3=NC4=CC=CC=C4N=C3

InChI

InChI=1S/C21H19ClN4O3/c22-15-4-3-5-16(12-15)25-8-10-26(11-9-25)20(27)14-29-21(28)19-13-23-17-6-1-2-7-18(17)24-19/h1-7,12-13H,8-11,14H2