N-(1-adamantyl)-N-[(3-methoxyphenyl)methyl]-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanamide

Systemtic Name: N-(1-adamantyl)-N-[(3-methoxyphenyl)methyl]-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanamide Openeye Name: N-(1-adamantyl)-N-[(3-methoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide CAS Name: N-(1-adamantyl)-N-[(3-methoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide IUPAC Name: N-(1-adamantyl)-N-[(3-methoxyphenyl)methyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide Traditional Name: N-(1-adamantyl)-2-(4-keto-1,2,3-benzotriazin-3-yl)-N-m-anisyl-acetamide Formula: C27H30N4O3 MolecularWeight: 458.5521

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(C(=O)CN2C(=O)C3=CC=CC=C3N=N2)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COC1=CC=CC(=C1)CN(C(=O)CN2C(=O)C3=CC=CC=C3N=N2)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H30N4O3/c1-34-22-6-4-5-18(12-22)16-30(27-13-19-9-20(14-27)11-21(10-19)15-27)25(32)17-31-26(33)23-7-2-3-8-24(23)28-29-31/h2-8,12,19-21H,9-11,13-17H2,1H3