N,N-diethyl-5-phenyl-2,3-dihydro-1H-pyrazolo[1,2-a]indazol-4-ium-7-carboxamide chloride

Systemtic Name: N,N-diethyl-5-phenyl-2,3-dihydro-1H-pyrazolo[1,2-a]indazol-4-ium-7-carboxamide chloride Openeye Name: N,N-diethyl-5-phenyl-2,3-dihydro-1H-pyrazolo[1,2-a]indazol-4-ium-7-carboxamide chloride CAS Name: N,N-diethyl-5-phenyl-2,3-dihydro-1H-pyrazolo[1,2-a]indazol-4-ium-7-carboxamide chloride IUPAC Name: N,N-diethyl-5-phenyl-2,3-dihydro-1H-pyrazolo[1,2-a]indazol-4-ium-7-carboxamide chloride Traditional Name: N,N-diethyl-5-phenyl-2,3-dihydro-1H-pyrazol[1,2-a]indazol-4-ium-7-carboxamide chloride Formula: C21H24ClN3O MolecularWeight: 369.88776

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC2=C(C=C1)N3CCC[N+]3=C2C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=C(C=C1)N3CCC[N+]3=C2C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C21H24N3O.ClH/c1-3-22(4-2)21(25)17-11-12-19-18(15-17)20(16-9-6-5-7-10-16)24-14-8-13-23(19)24;/h5-7,9-12,15H,3-4,8,13-14H2,1-2H3;1H/q+1;/p-1