N-(4-chlorophenyl)-4-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl]cyclohexane-1-carboxamide

Systemtic Name: N-(4-chlorophenyl)-4-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl]cyclohexane-1-carboxamide Openeye Name: N-(4-chlorophenyl)-4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]cyclohexanecarboxamide CAS Name: N-(4-chlorophenyl)-4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]-1-cyclohexanecarboxamide IUPAC Name: N-(4-chlorophenyl)-4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]cyclohexane-1-carboxamide Traditional Name: N-(4-chlorophenyl)-4-[(4-keto-1,2,3-benzotriazin-3-yl)methyl]cyclohexanecarboxamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN2C(=O)C3=CC=CC=C3N=N2)C(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC(CCC1CN2C(=O)C3=CC=CC=C3N=N2)C(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN4O2/c22-16-9-11-17(12-10-16)23-20(27)15-7-5-14(6-8-15)13-26-21(28)18-3-1-2-4-19(18)24-25-26/h1-4,9-12,14-15H,5-8,13H2,(H,23,27)