2-(benzotriazol-1-yl)-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-pyrrol-3-yl]ethanone

Systemtic Name: 2-(benzotriazol-1-yl)-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 2-(benzotriazol-1-yl)-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-(1-benzotriazolyl)-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-(benzotriazol-1-yl)-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-(benzotriazol-1-yl)-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-pyrrol-3-yl]ethanone Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=C2)OCCO3)C)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=C2)OCCO3)C)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C22H20N4O3/c1-14-11-17(20(27)13-25-19-6-4-3-5-18(19)23-24-25)15(2)26(14)16-7-8-21-22(12-16)29-10-9-28-21/h3-8,11-12H,9-10,13H2,1-2H3