2-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[4-[2-(2,6-dimethylanilino)-2-oxo-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]-1-piperazin-1-iumyl]-N-prop-2-enylacetamide IUPAC Name: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperazin-1-ium-1-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[4-[2-(2,6-dimethylanilino)-2-keto-ethyl]piperazin-1-ium-1-yl]acetamide Formula: C19H29N4O2+ MolecularWeight: 345.45916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CC[NH+](CC2)CC(=O)NCC=C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CC[NH+](CC2)CC(=O)NCC=C

InChI

InChI=1S/C19H28N4O2/c1-4-8-20-17(24)13-22-9-11-23(12-10-22)14-18(25)21-19-15(2)6-5-7-16(19)3/h4-7H,1,8-14H2,2-3H3,(H,20,24)(H,21,25)/p+1