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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)CCNC(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)CCNC(=O)C3=CC(=CC=C3)C

InChI

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