N-[3-[4-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]benzamide

Systemtic Name: N-[3-[4-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]benzamide Openeye Name: N-[3-[4-[2-(2-ethylanilino)-2-oxo-ethyl]piperazin-4-ium-1-yl]-3-oxo-propyl]benzamide CAS Name: N-[3-[4-[2-(2-ethylanilino)-2-oxoethyl]-1-piperazin-4-iumyl]-3-oxopropyl]benzamide IUPAC Name: N-[3-[4-[2-(2-ethylanilino)-2-oxoethyl]piperazin-4-ium-1-yl]-3-oxopropyl]benzamide Traditional Name: N-[3-[4-[2-(2-ethylanilino)-2-keto-ethyl]piperazin-4-ium-1-yl]-3-keto-propyl]benzamide Formula: C24H31N4O3+ MolecularWeight: 423.52794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N4O3/c1-2-19-8-6-7-11-21(19)26-22(29)18-27-14-16-28(17-15-27)23(30)12-13-25-24(31)20-9-4-3-5-10-20/h3-11H,2,12-18H2,1H3,(H,25,31)(H,26,29)/p+1