7-methyl-3-phenyl-1,2,3,3a,4,5-hexahydropyrazolo[3,4-a]carbazol-10-ium chloride

Systemtic Name: 7-methyl-3-phenyl-1,2,3,3a,4,5-hexahydropyrazolo[3,4-a]carbazol-10-ium chloride Openeye Name: 7-methyl-3-phenyl-1,2,3,3a,4,5-hexahydropyrazolo[3,4-a]carbazol-10-ium chloride CAS Name: 7-methyl-3-phenyl-1,2,3,3a,4,5-hexahydropyrazolo[3,4-a]carbazol-10-ium chloride IUPAC Name: 7-methyl-3-phenyl-1,2,3,3a,4,5-hexahydropyrazolo[3,4-a]carbazol-10-ium chloride Traditional Name: 7-methyl-3-phenyl-1,2,3,3a,4,5-hexahydropyrazolo[3,4-a]carbazol-10-ium chloride Formula: C20H20ClN3 MolecularWeight: 337.8459

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C3CCC4C(NNC4=C3[NH+]=C2C=C1)C5=CC=CC=C5.[Cl-]

Isomeric SMILES

CC1=CC2=C3CCC4C(NNC4=C3[NH+]=C2C=C1)C5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C20H19N3.ClH/c1-12-7-10-17-16(11-12)14-8-9-15-18(13-5-3-2-4-6-13)22-23-20(15)19(14)21-17;/h2-7,10-11,15,18,22-23H,8-9H2,1H3;1H