(6-butoxynaphthalen-2-yl)-(3-oxidanidylbenzotriazol-3-ium-1-yl)methanone

Systemtic Name: (6-butoxynaphthalen-2-yl)-(3-oxidanidylbenzotriazol-3-ium-1-yl)methanone Openeye Name: (6-butoxy-2-naphthyl)-(3-oxidobenzotriazol-3-ium-1-yl)methanone CAS Name: (6-butoxy-2-naphthalenyl)-(3-oxido-1-benzotriazol-3-iumyl)methanone IUPAC Name: (6-butoxynaphthalen-2-yl)-(3-oxidobenzotriazol-3-ium-1-yl)methanone Traditional Name: (6-butoxy-2-naphthyl)-(3-oxidobenzotriazol-3-ium-1-yl)methanone Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C=C(C=C2)C(=O)N3C4=CC=CC=C4[N+](=N3)[O-]

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C=C(C=C2)C(=O)N3C4=CC=CC=C4[N+](=N3)[O-]

InChI

InChI=1S/C21H19N3O3/c1-2-3-12-27-18-11-10-15-13-17(9-8-16(15)14-18)21(25)23-19-6-4-5-7-20(19)24(26)22-23/h4-11,13-14H,2-3,12H2,1H3