[6-(4-methylpentoxy)naphthalen-2-yl]-(3-oxidanidylbenzotriazol-3-ium-1-yl)methanone

Systemtic Name: [6-(4-methylpentoxy)naphthalen-2-yl]-(3-oxidanidylbenzotriazol-3-ium-1-yl)methanone Openeye Name: (6-isohexyloxy-2-naphthyl)-(3-oxidobenzotriazol-3-ium-1-yl)methanone CAS Name: [6-(4-methylpentoxy)-2-naphthalenyl]-(3-oxido-1-benzotriazol-3-iumyl)methanone IUPAC Name: [6-(4-methylpentoxy)naphthalen-2-yl]-(3-oxidobenzotriazol-3-ium-1-yl)methanone Traditional Name: (6-isohexyloxy-2-naphthyl)-(3-oxidobenzotriazol-3-ium-1-yl)methanone Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC1=CC2=C(C=C1)C=C(C=C2)C(=O)N3C4=CC=CC=C4[N+](=N3)[O-]

Isomeric SMILES

CC(C)CCCOC1=CC2=C(C=C1)C=C(C=C2)C(=O)N3C4=CC=CC=C4[N+](=N3)[O-]

InChI

InChI=1S/C23H23N3O3/c1-16(2)6-5-13-29-20-12-11-17-14-19(10-9-18(17)15-20)23(27)25-21-7-3-4-8-22(21)26(28)24-25/h3-4,7-12,14-16H,5-6,13H2,1-2H3