(E)-1-[6-tert-butyl-9-(4-methylphenyl)carbonyl-1,2,3,4-tetrahydrocarbazol-3-yl]-2-diazonio-ethenolate

Systemtic Name: (E)-1-[6-tert-butyl-9-(4-methylphenyl)carbonyl-1,2,3,4-tetrahydrocarbazol-3-yl]-2-diazonio-ethenolate Openeye Name: (E)-1-[6-tert-butyl-9-(4-methylbenzoyl)-1,2,3,4-tetrahydrocarbazol-3-yl]-2-diazonio-ethenolate CAS Name: (E)-1-[6-tert-butyl-9-[(4-methylphenyl)-oxomethyl]-1,2,3,4-tetrahydrocarbazol-3-yl]-2-diazonioethenolate IUPAC Name: (E)-1-[6-tert-butyl-9-(4-methylbenzoyl)-1,2,3,4-tetrahydrocarbazol-3-yl]-2-diazonioethenolate Traditional Name: (E)-1-(6-tert-butyl-9-p-toluoyl-1,2,3,4-tetrahydrocarbazol-3-yl)-2-diazonio-ethenolate Formula: C26H27N3O2 MolecularWeight: 413.51148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C3=C(CC(CC3)C(=C[N+]#N)[O-])C4=C2C=CC(=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C3=C(CC(CC3)/C(=C\[N+]#N)/[O-])C4=C2C=CC(=C4)C(C)(C)C

InChI

InChI=1S/C26H27N3O2/c1-16-5-7-17(8-6-16)25(31)29-22-11-9-18(24(30)15-28-27)13-20(22)21-14-19(26(2,3)4)10-12-23(21)29/h5-8,10,12,14-15,18H,9,11,13H2,1-4H3/b24-15+