N'-[1-(4-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethyl]-3-(4-phenylpiperazin-1-ium-1-yl)propanehydrazide

Systemtic Name: N'-[1-(4-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethyl]-3-(4-phenylpiperazin-1-ium-1-yl)propanehydrazide Openeye Name: N'-[1-(4-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)ethyl]-3-(4-phenylpiperazin-1-ium-1-yl)propanehydrazide CAS Name: N'-[1-(4-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)ethyl]-3-(4-phenyl-1-piperazin-1-iumyl)propanehydrazide IUPAC Name: N'-[1-(4-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)ethyl]-3-(4-phenylpiperazin-1-ium-1-yl)propanehydrazide Traditional Name: N'-[1-(6-keto-4-methoxy-cyclohexa-2,4-dien-1-ylidene)ethyl]-3-(4-phenylpiperazin-1-ium-1-yl)propionohydrazide Formula: C22H29N4O3+ MolecularWeight: 397.49066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC(=CC1=O)OC)NNC(=O)CC[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC(=C1C=CC(=CC1=O)OC)NNC(=O)CC[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C22H28N4O3/c1-17(20-9-8-19(29-2)16-21(20)27)23-24-22(28)10-11-25-12-14-26(15-13-25)18-6-4-3-5-7-18/h3-9,16,23H,10-15H2,1-2H3,(H,24,28)/p+1