[1-[4-(8-methoxyoctoxy)phenyl]-3-oxidanidyl-benzotriazol-3-ium-4-yl]-phenyl-methanone

Systemtic Name: [1-[4-(8-methoxyoctoxy)phenyl]-3-oxidanidyl-benzotriazol-3-ium-4-yl]-phenyl-methanone Openeye Name: [1-[4-(8-methoxyoctoxy)phenyl]-3-oxido-benzotriazol-3-ium-4-yl]-phenyl-methanone CAS Name: [1-[4-(8-methoxyoctoxy)phenyl]-3-oxido-4-benzotriazol-3-iumyl]-phenylmethanone IUPAC Name: [1-[4-(8-methoxyoctoxy)phenyl]-3-oxidobenzotriazol-3-ium-4-yl]-phenylmethanone Traditional Name: [1-[4-(8-methoxyoctoxy)phenyl]-3-oxido-benzotriazol-3-ium-4-yl]-phenyl-methanone Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCCCCCOC1=CC=C(C=C1)N2C3=CC=CC(=C3[N+](=N2)[O-])C(=O)C4=CC=CC=C4

Isomeric SMILES

COCCCCCCCCOC1=CC=C(C=C1)N2C3=CC=CC(=C3[N+](=N2)[O-])C(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H31N3O4/c1-34-20-9-4-2-3-5-10-21-35-24-18-16-23(17-19-24)30-26-15-11-14-25(27(26)31(33)29-30)28(32)22-12-7-6-8-13-22/h6-8,11-19H,2-5,9-10,20-21H2,1H3