[2-[[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]amino]-2-oxidanylidene-ethyl] 2-methylpropanoate

Systemtic Name: [2-[[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]amino]-2-oxidanylidene-ethyl] 2-methylpropanoate Openeye Name: [2-[[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]amino]-2-oxo-ethyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [2-[[2-(4-dimethylaminophenyl)-2-(4-methyl-1-piperazinyl)ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[2-(4-dimethylaminophenyl)-2-(4-methylpiperazin-1-yl)ethyl]amino]-2-oxoethyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [2-[[2-(4-dimethylaminophenyl)-2-(4-methylpiperazino)ethyl]amino]-2-keto-ethyl] ester Formula: C21H34N4O3 MolecularWeight: 390.51966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OCC(=O)NCC(C1=CC=C(C=C1)N(C)C)N2CCN(CC2)C

Isomeric SMILES

CC(C)C(=O)OCC(=O)NCC(C1=CC=C(C=C1)N(C)C)N2CCN(CC2)C

InChI

InChI=1S/C21H34N4O3/c1-16(2)21(27)28-15-20(26)22-14-19(25-12-10-24(5)11-13-25)17-6-8-18(9-7-17)23(3)4/h6-9,16,19H,10-15H2,1-5H3,(H,22,26)