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

Systemtic Name: 2-(benzotriazol-1-yl)-1-[1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 2-(benzotriazol-1-yl)-1-[1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-(1-benzotriazolyl)-1-[1-(3,4-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-(benzotriazol-1-yl)-1-[1-(3,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-(benzotriazol-1-yl)-1-[1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Formula: C22H22N4O MolecularWeight: 358.43628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=C2C)C(=O)CN3C4=CC=CC=C4N=N3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=C2C)C(=O)CN3C4=CC=CC=C4N=N3)C)C

InChI

InChI=1S/C22H22N4O/c1-14-9-10-18(11-15(14)2)26-16(3)12-19(17(26)4)22(27)13-25-21-8-6-5-7-20(21)23-24-25/h5-12H,13H2,1-4H3