[4-[4-[(4-methylpiperazin-4-ium-1-yl)carbamoyl]phenyl]phenyl] ethanoate

Systemtic Name: [4-[4-[(4-methylpiperazin-4-ium-1-yl)carbamoyl]phenyl]phenyl] ethanoate Openeye Name: [4-[4-[(4-methylpiperazin-4-ium-1-yl)carbamoyl]phenyl]phenyl] acetate CAS Name: acetic acid [4-[4-[[(4-methyl-1-piperazin-4-iumyl)amino]-oxomethyl]phenyl]phenyl] ester IUPAC Name: [4-[4-[(4-methylpiperazin-4-ium-1-yl)carbamoyl]phenyl]phenyl] acetate Traditional Name: acetic acid [4-[4-[(4-methylpiperazin-4-ium-1-yl)carbamoyl]phenyl]phenyl] ester Formula: C20H24N3O3+ MolecularWeight: 354.42286

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NN3CC[NH+](CC3)C

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NN3CC[NH+](CC3)C

InChI

InChI=1S/C20H23N3O3/c1-15(24)26-19-9-7-17(8-10-19)16-3-5-18(6-4-16)20(25)21-23-13-11-22(2)12-14-23/h3-10H,11-14H2,1-2H3,(H,21,25)/p+1