(E)-2-[9-(4-tert-butylphenyl)carbonyl-6-hexyl-1,2,3,4-tetrahydrocarbazol-3-yl]-2-oxidanyl-ethenediazonium

Systemtic Name: (E)-2-[9-(4-tert-butylphenyl)carbonyl-6-hexyl-1,2,3,4-tetrahydrocarbazol-3-yl]-2-oxidanyl-ethenediazonium Openeye Name: (E)-2-[9-(4-tert-butylbenzoyl)-6-hexyl-1,2,3,4-tetrahydrocarbazol-3-yl]-2-hydroxy-ethenediazonium CAS Name: (E)-2-[9-[(4-tert-butylphenyl)-oxomethyl]-6-hexyl-1,2,3,4-tetrahydrocarbazol-3-yl]-2-hydroxyethenediazonium IUPAC Name: (E)-2-[9-(4-tert-butylbenzoyl)-6-hexyl-1,2,3,4-tetrahydrocarbazol-3-yl]-2-hydroxyethenediazonium Traditional Name: (E)-2-[9-(4-tert-butylbenzoyl)-6-hexyl-1,2,3,4-tetrahydrocarbazol-3-yl]-2-hydroxy-ethenediazonium Formula: C31H38N3O2+ MolecularWeight: 484.65232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(C=C1)N(C3=C2CC(CC3)C(=C[N+]#N)O)C(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCCCCCC1=CC2=C(C=C1)N(C3=C2CC(CC3)/C(=C\[N+]#N)/O)C(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C31H37N3O2/c1-5-6-7-8-9-21-10-16-27-25(18-21)26-19-23(29(35)20-33-32)13-17-28(26)34(27)30(36)22-11-14-24(15-12-22)31(2,3)4/h10-12,14-16,18,20,23H,5-9,13,17,19H2,1-4H3/p+1/b29-20+