N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[2-(2-ethylanilino)-2-oxo-ethyl]-N-methyl-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[2-(2-ethylanilino)-2-keto-ethyl]-N-methyl-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C23H31N4O2+ MolecularWeight: 395.51784

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C23H30N4O2/c1-3-19-9-7-8-12-21(19)24-22(28)17-25(2)23(29)18-26-13-15-27(16-14-26)20-10-5-4-6-11-20/h4-12H,3,13-18H2,1-2H3,(H,24,28)/p+1