[2,6-dimethoxy-4-[(Z)-[3-(4-phenylpiperazin-1-ium-1-yl)propanoylhydrazinylidene]methyl]phenyl] ethanoate

Systemtic Name: [2,6-dimethoxy-4-[(Z)-[3-(4-phenylpiperazin-1-ium-1-yl)propanoylhydrazinylidene]methyl]phenyl] ethanoate Openeye Name: [2,6-dimethoxy-4-[(Z)-[3-(4-phenylpiperazin-1-ium-1-yl)propanoylhydrazono]methyl]phenyl] acetate CAS Name: acetic acid [2,6-dimethoxy-4-[(Z)-[[1-oxo-3-(4-phenyl-1-piperazin-1-iumyl)propyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2,6-dimethoxy-4-[(Z)-[3-(4-phenylpiperazin-1-ium-1-yl)propanoylhydrazinylidene]methyl]phenyl] acetate Traditional Name: acetic acid [2,6-dimethoxy-4-[(Z)-[3-(4-phenylpiperazin-1-ium-1-yl)propanoylhydrazono]methyl]phenyl] ester Formula: C24H31N4O5+ MolecularWeight: 455.52674

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1OC)C=NNC(=O)CC[NH+]2CCN(CC2)C3=CC=CC=C3)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1OC)/C=N\NC(=O)CC[NH+]2CCN(CC2)C3=CC=CC=C3)OC

InChI

InChI=1S/C24H30N4O5/c1-18(29)33-24-21(31-2)15-19(16-22(24)32-3)17-25-26-23(30)9-10-27-11-13-28(14-12-27)20-7-5-4-6-8-20/h4-8,15-17H,9-14H2,1-3H3,(H,26,30)/p+1/b25-17-