2-[2-[4-[(E)-diazanylidenemethyl]phenyl]-3-methyl-1-piperazin-1-yl-piperidin-1-ium-1-yl]ethanoic acid

Systemtic Name: 2-[2-[4-[(E)-diazanylidenemethyl]phenyl]-3-methyl-1-piperazin-1-yl-piperidin-1-ium-1-yl]ethanoic acid Openeye Name: 2-[2-[4-[(E)-hydrazinylidenemethyl]phenyl]-3-methyl-1-piperazin-1-yl-piperidin-1-ium-1-yl]acetic acid CAS Name: 2-[2-[4-[(E)-hydrazinylidenemethyl]phenyl]-3-methyl-1-(1-piperazinyl)-1-piperidin-1-iumyl]acetic acid IUPAC Name: 2-[2-[4-[(E)-hydrazinylidenemethyl]phenyl]-3-methyl-1-piperazin-1-ylpiperidin-1-ium-1-yl]acetic acid Traditional Name: 2-[2-[4-[(E)-hydrazonomethyl]phenyl]-3-methyl-1-piperazino-piperidin-1-ium-1-yl]acetic acid Formula: C19H30N5O2+ MolecularWeight: 360.4738

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[N+](C1C2=CC=C(C=C2)C=NN)(CC(=O)O)N3CCNCC3

Isomeric SMILES

CC1CCC[N+](C1C2=CC=C(C=C2)/C=N/N)(CC(=O)O)N3CCNCC3

InChI

InChI=1S/C19H29N5O2/c1-15-3-2-12-24(14-18(25)26,23-10-8-21-9-11-23)19(15)17-6-4-16(5-7-17)13-22-20/h4-7,13,15,19,21H,2-3,8-12,14,20H2,1H3/p+1/b22-13+