3-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[2-(1-isopentyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[2-[2,5-dimethyl-1-(3-methylbutyl)-3-pyrrolyl]-2-oxoethyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[2-(1-isoamyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl]-1,2,3-benzotriazin-4-one Formula: C20H24N4O2 MolecularWeight: 352.43016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC(C)C)C)C(=O)CN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=CC(=C(N1CCC(C)C)C)C(=O)CN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C20H24N4O2/c1-13(2)9-10-23-14(3)11-17(15(23)4)19(25)12-24-20(26)16-7-5-6-8-18(16)21-22-24/h5-8,11,13H,9-10,12H2,1-4H3