8-methyl-3-(2,4,7-triphenylcyclohepta-1,3,6-trien-1-yl)-2H-1,3-benzoxazin-3-ium

Systemtic Name: 8-methyl-3-(2,4,7-triphenylcyclohepta-1,3,6-trien-1-yl)-2H-1,3-benzoxazin-3-ium Openeye Name: 8-methyl-3-(2,4,7-triphenylcyclohepta-1,3,6-trien-1-yl)-2H-1,3-benzoxazin-3-ium CAS Name: 8-methyl-3-(2,4,7-triphenyl-1-cyclohepta-1,3,6-trienyl)-2H-1,3-benzoxazin-3-ium IUPAC Name: 8-methyl-3-(2,4,7-triphenylcyclohepta-1,3,6-trien-1-yl)-2H-1,3-benzoxazin-3-ium Traditional Name: 8-methyl-3-(2,4,7-triphenylcyclohepta-1,3,6-trien-1-yl)-2H-1,3-benzoxazin-3-ium Formula: C34H28NO+ MolecularWeight: 466.59222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OC[N+](=C2)C3=C(C=C(CC=C3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=CC2=C1OC[N+](=C2)C3=C(C=C(CC=C3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H28NO/c1-25-12-11-19-30-23-35(24-36-34(25)30)33-31(27-15-7-3-8-16-27)21-20-29(26-13-5-2-6-14-26)22-32(33)28-17-9-4-10-18-28/h2-19,21-23H,20,24H2,1H3/q+1