5-chloranyl-N-(1-ethylpiperidin-1-ium-4-yl)-3-methyl-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-(1-ethylpiperidin-1-ium-4-yl)-3-methyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-N-(1-ethylpiperidin-1-ium-4-yl)-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-(1-ethyl-4-piperidin-1-iumyl)-3-methyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-N-(1-ethylpiperidin-1-ium-4-yl)-3-methylpyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-N-(1-ethylpiperidin-1-ium-4-yl)-3-methyl-pyrazole-4-carboxamide Formula: C19H26ClN4O+ MolecularWeight: 361.88894

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3)Cl

Isomeric SMILES

CC[NH+]1CCC(CC1)NC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C19H25ClN4O/c1-3-23-11-9-16(10-12-23)21-19(25)17-14(2)22-24(18(17)20)13-15-7-5-4-6-8-15/h4-8,16H,3,9-13H2,1-2H3,(H,21,25)/p+1