[6-(8-methoxyoctoxy)naphthalen-2-yl]-(3-oxidanidylbenzotriazol-3-ium-1-yl)methanone

Systemtic Name: [6-(8-methoxyoctoxy)naphthalen-2-yl]-(3-oxidanidylbenzotriazol-3-ium-1-yl)methanone Openeye Name: [6-(8-methoxyoctoxy)-2-naphthyl]-(3-oxidobenzotriazol-3-ium-1-yl)methanone CAS Name: [6-(8-methoxyoctoxy)-2-naphthalenyl]-(3-oxido-1-benzotriazol-3-iumyl)methanone IUPAC Name: [6-(8-methoxyoctoxy)naphthalen-2-yl]-(3-oxidobenzotriazol-3-ium-1-yl)methanone Traditional Name: [6-(8-methoxyoctoxy)-2-naphthyl]-(3-oxidobenzotriazol-3-ium-1-yl)methanone Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCCCCCOC1=CC2=C(C=C1)C=C(C=C2)C(=O)N3C4=CC=CC=C4[N+](=N3)[O-]

Isomeric SMILES

COCCCCCCCCOC1=CC2=C(C=C1)C=C(C=C2)C(=O)N3C4=CC=CC=C4[N+](=N3)[O-]

InChI

InChI=1S/C26H29N3O4/c1-32-16-8-4-2-3-5-9-17-33-23-15-14-20-18-22(13-12-21(20)19-23)26(30)28-24-10-6-7-11-25(24)29(31)27-28/h6-7,10-15,18-19H,2-5,8-9,16-17H2,1H3