2-(benzotriazol-1-yl)-1-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)ethanone

Systemtic Name: 2-(benzotriazol-1-yl)-1-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)ethanone Openeye Name: 1-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-(benzotriazol-1-yl)ethanone CAS Name: 2-(1-benzotriazolyl)-1-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)ethanone IUPAC Name: 2-(benzotriazol-1-yl)-1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)ethanone Traditional Name: 1-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-(benzotriazol-1-yl)ethanone Formula: C17H18N4O MolecularWeight: 294.35102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H18N4O/c1-4-9-20-12(2)10-14(13(20)3)17(22)11-21-16-8-6-5-7-15(16)18-19-21/h4-8,10H,1,9,11H2,2-3H3