3-oxidanylideneprop-2-enyl 2-aminocarbonyl-3-[4-(2-chlorophenyl)piperazin-1-yl]oxirane-2-carboxylate

Systemtic Name: 3-oxidanylideneprop-2-enyl 2-aminocarbonyl-3-[4-(2-chlorophenyl)piperazin-1-yl]oxirane-2-carboxylate Openeye Name: 3-oxoallyl 2-carbamoyl-3-[4-(2-chlorophenyl)piperazin-1-yl]oxirane-2-carboxylate CAS Name: 2-carbamoyl-3-[4-(2-chlorophenyl)-1-piperazinyl]-2-oxiranecarboxylic acid 3-oxoprop-2-enyl ester IUPAC Name: 3-oxoprop-2-enyl 2-carbamoyl-3-[4-(2-chlorophenyl)piperazin-1-yl]oxirane-2-carboxylate Traditional Name: 2-carbamoyl-3-[4-(2-chlorophenyl)piperazino]oxirane-2-carboxylic acid 3-ketoallyl ester Formula: C17H18ClN3O5 MolecularWeight: 379.79492

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2C(O2)(C(=O)N)C(=O)OCC=C=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CCN1C2C(O2)(C(=O)N)C(=O)OCC=C=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C17H18ClN3O5/c18-12-4-1-2-5-13(12)20-6-8-21(9-7-20)15-17(26-15,14(19)23)16(24)25-11-3-10-22/h1-5,15H,6-9,11H2,(H2,19,23)