1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(6-chloranylbenzotriazol-1-yl)oxy-ethanone

Systemtic Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(6-chloranylbenzotriazol-1-yl)oxy-ethanone Openeye Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(6-chlorobenzotriazol-1-yl)oxy-ethanone CAS Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-3-pyrrolyl]-2-[(6-chloro-1-benzotriazolyl)oxy]ethanone IUPAC Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethylpyrrol-3-yl]-2-(6-chlorobenzotriazol-1-yl)oxyethanone Traditional Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(6-chlorobenzotriazol-1-yl)oxy-ethanone Formula: C21H17ClN4O4 MolecularWeight: 424.83708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C(=O)CON4C5=C(C=CC(=C5)Cl)N=N4

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C(=O)CON4C5=C(C=CC(=C5)Cl)N=N4

InChI

InChI=1S/C21H17ClN4O4/c1-12-7-16(13(2)25(12)15-4-6-20-21(9-15)29-11-28-20)19(27)10-30-26-18-8-14(22)3-5-17(18)23-24-26/h3-9H,10-11H2,1-2H3