3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)-N-(4-pentylphenyl)propanamide

Systemtic Name: 3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)-N-(4-pentylphenyl)propanamide Openeye Name: 3-(4-oxo-1,2,3-benzotriazin-3-yl)-N-(4-pentylphenyl)propanamide CAS Name: 3-(4-oxo-1,2,3-benzotriazin-3-yl)-N-(4-pentylphenyl)propanamide IUPAC Name: 3-(4-oxo-1,2,3-benzotriazin-3-yl)-N-(4-pentylphenyl)propanamide Traditional Name: N-(4-amylphenyl)-3-(4-keto-1,2,3-benzotriazin-3-yl)propionamide Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C21H24N4O2/c1-2-3-4-7-16-10-12-17(13-11-16)22-20(26)14-15-25-21(27)18-8-5-6-9-19(18)23-24-25/h5-6,8-13H,2-4,7,14-15H2,1H3,(H,22,26)