N-cycloheptyl-3-oxidanylidene-2-phenyl-5-(phenylmethyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide

Systemtic Name: N-cycloheptyl-3-oxidanylidene-2-phenyl-5-(phenylmethyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Openeye Name: 5-benzyl-N-cycloheptyl-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide CAS Name: N-cycloheptyl-3-oxo-2-phenyl-5-(phenylmethyl)-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide IUPAC Name: 5-benzyl-N-cycloheptyl-3-oxo-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Traditional Name: 5-benzyl-N-cycloheptyl-3-keto-2-phenyl-1H-pyrazolo[4,3-c]pyridin-5-ium-7-carboxamide Formula: C27H29N4O2+ MolecularWeight: 441.54476

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2=C3C(=C[N+](=C2)CC4=CC=CC=C4)C(=O)N(N3)C5=CC=CC=C5

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2=C3C(=C[N+](=C2)CC4=CC=CC=C4)C(=O)N(N3)C5=CC=CC=C5

InChI

InChI=1S/C27H28N4O2/c32-26(28-21-13-7-1-2-8-14-21)23-18-30(17-20-11-5-3-6-12-20)19-24-25(23)29-31(27(24)33)22-15-9-4-10-16-22/h3-6,9-12,15-16,18-19,21H,1-2,7-8,13-14,17H2,(H,28,32)/p+1