[2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-azanium

Systemtic Name: [2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-azanium Openeye Name: [2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxo-ethyl]-[2-(2-methylanilino)-2-oxo-ethyl]-propyl-ammonium CAS Name: [2-(4-ethoxycarbonyl-1-piperazinyl)-2-oxoethyl]-[2-(2-methylanilino)-2-oxoethyl]-propylammonium IUPAC Name: [2-(4-ethoxycarbonylpiperazin-1-yl)-2-oxoethyl]-[2-(2-methylanilino)-2-oxoethyl]-propylazanium Traditional Name: [2-(4-carbethoxypiperazino)-2-keto-ethyl]-[2-keto-2-(o-toluidino)ethyl]-propyl-ammonium Formula: C21H33N4O4+ MolecularWeight: 405.51112

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC(=O)NC1=CC=CC=C1C)CC(=O)N2CCN(CC2)C(=O)OCC

Isomeric SMILES

CCC[NH+](CC(=O)NC1=CC=CC=C1C)CC(=O)N2CCN(CC2)C(=O)OCC

InChI

InChI=1S/C21H32N4O4/c1-4-10-23(15-19(26)22-18-9-7-6-8-17(18)3)16-20(27)24-11-13-25(14-12-24)21(28)29-5-2/h6-9H,4-5,10-16H2,1-3H3,(H,22,26)/p+1