N-[(1-methylpiperidin-1-ium-4-ylidene)amino]-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-[(1-methylpiperidin-1-ium-4-ylidene)amino]-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[(1-methylpiperidin-1-ium-4-ylidene)amino]-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[(1-methyl-4-piperidin-1-iumylidene)amino]-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[(1-methylpiperidin-1-ium-4-ylidene)amino]-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-[(1-methylpiperidin-1-ium-4-ylidene)amino]-1,3-diphenyl-pyrazole-4-carboxamide Formula: C22H24N5O+ MolecularWeight: 374.45886

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(=NNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)CC1

Isomeric SMILES

C[NH+]1CCC(=NNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)CC1

InChI

InChI=1S/C22H23N5O/c1-26-14-12-18(13-15-26)23-24-22(28)20-16-27(19-10-6-3-7-11-19)25-21(20)17-8-4-2-5-9-17/h2-11,16H,12-15H2,1H3,(H,24,28)/p+1