2-chloranyl-5-[2-[1-(phenylmethyl)piperidin-1-ium-4-ylidene]hydrazinyl]benzoate

Systemtic Name: 2-chloranyl-5-[2-[1-(phenylmethyl)piperidin-1-ium-4-ylidene]hydrazinyl]benzoate Openeye Name: 5-[2-(1-benzylpiperidin-1-ium-4-ylidene)hydrazino]-2-chloro-benzoate CAS Name: 2-chloro-5-[2-[1-(phenylmethyl)-4-piperidin-1-iumylidene]hydrazinyl]benzoate IUPAC Name: 5-[2-(1-benzylpiperidin-1-ium-4-ylidene)hydrazinyl]-2-chlorobenzoate Traditional Name: 5-[N'-(1-benzylpiperidin-1-ium-4-ylidene)hydrazino]-2-chloro-benzoate Formula: C19H20ClN3O2 MolecularWeight: 357.834

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1=NNC2=CC(=C(C=C2)Cl)C(=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1=NNC2=CC(=C(C=C2)Cl)C(=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C19H20ClN3O2/c20-18-7-6-16(12-17(18)19(24)25)22-21-15-8-10-23(11-9-15)13-14-4-2-1-3-5-14/h1-7,12,22H,8-11,13H2,(H,24,25)