N-(3,4-dichlorophenyl)-4-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-(3,4-dichlorophenyl)-4-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperazin-4-ium-1-carboxamide Openeye Name: 4-[2-(allylamino)-2-oxo-ethyl]-N-(3,4-dichlorophenyl)piperazin-4-ium-1-carboxamide CAS Name: N-(3,4-dichlorophenyl)-4-[2-oxo-2-(prop-2-enylamino)ethyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(3,4-dichlorophenyl)-4-[2-oxo-2-(prop-2-enylamino)ethyl]piperazin-4-ium-1-carboxamide Traditional Name: 4-[2-(allylamino)-2-keto-ethyl]-N-(3,4-dichlorophenyl)piperazin-4-ium-1-carboxamide Formula: C16H21Cl2N4O2+ MolecularWeight: 372.26954

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C[NH+]1CCN(CC1)C(=O)NC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C=CCNC(=O)C[NH+]1CCN(CC1)C(=O)NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H20Cl2N4O2/c1-2-5-19-15(23)11-21-6-8-22(9-7-21)16(24)20-12-3-4-13(17)14(18)10-12/h2-4,10H,1,5-9,11H2,(H,19,23)(H,20,24)/p+1