3,4-dimethoxy-N'-[2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanoyl]benzohydrazide

Systemtic Name: 3,4-dimethoxy-N'-[2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanoyl]benzohydrazide Openeye Name: N'-[2-(4-benzylpiperidin-1-ium-1-yl)acetyl]-3,4-dimethoxy-benzohydrazide CAS Name: 3,4-dimethoxy-N'-[1-oxo-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]ethyl]benzohydrazide IUPAC Name: N'-[2-(4-benzylpiperidin-1-ium-1-yl)acetyl]-3,4-dimethoxybenzohydrazide Traditional Name: N'-[2-(4-benzylpiperidin-1-ium-1-yl)acetyl]-3,4-dimethoxy-benzohydrazide Formula: C23H30N3O4+ MolecularWeight: 412.502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=O)C[NH+]2CCC(CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=O)C[NH+]2CCC(CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C23H29N3O4/c1-29-20-9-8-19(15-21(20)30-2)23(28)25-24-22(27)16-26-12-10-18(11-13-26)14-17-6-4-3-5-7-17/h3-9,15,18H,10-14,16H2,1-2H3,(H,24,27)(H,25,28)/p+1