5-chloranyl-3-methyl-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)piperidin-1-ium-4-yl]-5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidin-1-iumyl]-5-chloro-3-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-1-ium-4-yl]-5-chloro-3-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)piperidin-1-ium-4-yl]-5-chloro-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C24H27ClN5O2+ MolecularWeight: 452.95648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C24H26ClN5O2/c1-17-22(23(25)30(28-17)20-10-6-3-7-11-20)24(32)27-19-12-14-29(15-13-19)16-21(31)26-18-8-4-2-5-9-18/h2-11,19H,12-16H2,1H3,(H,26,31)(H,27,32)/p+1