N'-[2-[(4-methylphenyl)amino]ethanoyl]-4-(piperidin-1-ium-1-ylmethyl)benzohydrazide

Systemtic Name: N'-[2-[(4-methylphenyl)amino]ethanoyl]-4-(piperidin-1-ium-1-ylmethyl)benzohydrazide Openeye Name: N'-[2-(4-methylanilino)acetyl]-4-(piperidin-1-ium-1-ylmethyl)benzohydrazide CAS Name: N'-[2-(4-methylanilino)-1-oxoethyl]-4-(1-piperidin-1-iumylmethyl)benzohydrazide IUPAC Name: N'-[2-(4-methylanilino)acetyl]-4-(piperidin-1-ium-1-ylmethyl)benzohydrazide Traditional Name: 4-(piperidin-1-ium-1-ylmethyl)-N'-[2-(p-toluidino)acetyl]benzohydrazide Formula: C22H29N4O2+ MolecularWeight: 381.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCC(=O)NNC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NCC(=O)NNC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C22H28N4O2/c1-17-5-11-20(12-6-17)23-15-21(27)24-25-22(28)19-9-7-18(8-10-19)16-26-13-3-2-4-14-26/h5-12,23H,2-4,13-16H2,1H3,(H,24,27)(H,25,28)/p+1