[3-oxidanidyl-1-[4-(5-phenoxypentoxy)phenyl]benzotriazol-3-ium-4-yl]-phenyl-methanone

Systemtic Name: [3-oxidanidyl-1-[4-(5-phenoxypentoxy)phenyl]benzotriazol-3-ium-4-yl]-phenyl-methanone Openeye Name: [3-oxido-1-[4-(5-phenoxypentoxy)phenyl]benzotriazol-3-ium-4-yl]-phenyl-methanone CAS Name: [3-oxido-1-[4-(5-phenoxypentoxy)phenyl]-4-benzotriazol-3-iumyl]-phenylmethanone IUPAC Name: [3-oxido-1-[4-(5-phenoxypentoxy)phenyl]benzotriazol-3-ium-4-yl]-phenylmethanone Traditional Name: [3-oxido-1-[4-(5-phenoxypentoxy)phenyl]benzotriazol-3-ium-4-yl]-phenyl-methanone Formula: C30H27N3O4 MolecularWeight: 493.55308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C3C(=CC=C2)N(N=[N+]3[O-])C4=CC=C(C=C4)OCCCCCOC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C3C(=CC=C2)N(N=[N+]3[O-])C4=CC=C(C=C4)OCCCCCOC5=CC=CC=C5

InChI

InChI=1S/C30H27N3O4/c34-30(23-11-4-1-5-12-23)27-15-10-16-28-29(27)33(35)31-32(28)24-17-19-26(20-18-24)37-22-9-3-8-21-36-25-13-6-2-7-14-25/h1-2,4-7,10-20H,3,8-9,21-22H2