3-[[3-[4-(2-chlorophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]carbamoyl]oxirane-2-carboxylate

Systemtic Name: 3-[[3-[4-(2-chlorophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]carbamoyl]oxirane-2-carboxylate Openeye Name: 3-[[3-[4-(2-chlorophenyl)piperazin-1-yl]-3-oxo-propyl]carbamoyl]oxirane-2-carboxylate CAS Name: 3-[[[3-[4-(2-chlorophenyl)-1-piperazinyl]-3-oxopropyl]amino]-oxomethyl]-2-oxiranecarboxylate IUPAC Name: 3-[[3-[4-(2-chlorophenyl)piperazin-1-yl]-3-oxopropyl]carbamoyl]oxirane-2-carboxylate Traditional Name: 3-[[3-[4-(2-chlorophenyl)piperazino]-3-keto-propyl]carbamoyl]oxirane-2-carboxylate Formula: C17H19ClN3O5- MolecularWeight: 380.80286

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)CCNC(=O)C3C(O3)C(=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)CCNC(=O)C3C(O3)C(=O)[O-]

InChI

InChI=1S/C17H20ClN3O5/c18-11-3-1-2-4-12(11)20-7-9-21(10-8-20)13(22)5-6-19-16(23)14-15(26-14)17(24)25/h1-4,14-15H,5-10H2,(H,19,23)(H,24,25)/p-1