2-(4-methoxyphenyl)-7-methyl-spiro[3H-1,2,4-benzotriazine-2,4-diium-4,1'-azinan-1-ium]

Systemtic Name: 2-(4-methoxyphenyl)-7-methyl-spiro[3H-1,2,4-benzotriazine-2,4-diium-4,1'-azinan-1-ium] Openeye Name: 2-(4-methoxyphenyl)-7-methyl-spiro[3H-1,2,4-benzotriazine-2,4-diium-4,1'-azinan-1-ium] CAS Name: 2-(4-methoxyphenyl)-7-methylspiro[3H-1,2,4-benzotriazine-2,4-diium-4,1'-azinan-1-ium] IUPAC Name: 2-(4-methoxyphenyl)-7-methylspiro[3H-1,2,4-benzotriazine-2,4-diium-4,1'-azinan-1-ium] Traditional Name: 2-(4-methoxyphenyl)-7-methyl-spiro[3H-1,2,4-benzotriazine-2,4-diium-4,1'-azinan-1-ium] Formula: C20H25N3O+2 MolecularWeight: 323.432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[N+]3(CCCCC3)C[N+](=N2)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC2=C(C=C1)[N+]3(CCCCC3)C[N+](=N2)C4=CC=C(C=C4)OC

InChI

InChI=1S/C20H25N3O/c1-16-6-11-20-19(14-16)21-22(15-23(20)12-4-3-5-13-23)17-7-9-18(24-2)10-8-17/h6-11,14H,3-5,12-13,15H2,1-2H3/q+2