(Z)-3-methyl-1-(3-oxidanidylbenzotriazol-3-ium-1-yl)tridec-2-en-1-one

Systemtic Name: (Z)-3-methyl-1-(3-oxidanidylbenzotriazol-3-ium-1-yl)tridec-2-en-1-one Openeye Name: (Z)-3-methyl-1-(3-oxidobenzotriazol-3-ium-1-yl)tridec-2-en-1-one CAS Name: (Z)-3-methyl-1-(3-oxido-1-benzotriazol-3-iumyl)-2-tridecen-1-one IUPAC Name: (Z)-3-methyl-1-(3-oxidobenzotriazol-3-ium-1-yl)tridec-2-en-1-one Traditional Name: (Z)-3-methyl-1-(3-oxidobenzotriazol-3-ium-1-yl)tridec-2-en-1-one Formula: C20H29N3O2 MolecularWeight: 343.46316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=CC(=O)N1C2=CC=CC=C2[N+](=N1)[O-])C

Isomeric SMILES

CCCCCCCCCC/C(=C\C(=O)N1C2=CC=CC=C2[N+](=N1)[O-])/C

InChI

InChI=1S/C20H29N3O2/c1-3-4-5-6-7-8-9-10-13-17(2)16-20(24)22-18-14-11-12-15-19(18)23(25)21-22/h11-12,14-16H,3-10,13H2,1-2H3/b17-16-