N'-[(5-ethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanehydrazide

Systemtic Name: N'-[(5-ethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanehydrazide Openeye Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N'-[(5-ethoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]acetohydrazide CAS Name: N'-[(5-ethoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-2-[4-(phenylmethyl)-1-piperazin-1-iumyl]acetohydrazide IUPAC Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N'-[(5-ethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetohydrazide Traditional Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N'-[(5-ethoxy-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]acetohydrazide Formula: C22H29N4O3+ MolecularWeight: 397.49066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=CNNC(=O)C[NH+]2CCN(CC2)CC3=CC=CC=C3)C1=O

Isomeric SMILES

CCOC1=CC=CC(=CNNC(=O)C[NH+]2CCN(CC2)CC3=CC=CC=C3)C1=O

InChI

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