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

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(4-keto-1,2,3-benzotriazin-3-yl)acetamide Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CN4C(=O)C5=CC=CC=C5N=N4

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)CN4C(=O)C5=CC=CC=C5N=N4

InChI

InChI=1S/C21H26N4O2/c1-13(21-9-14-6-15(10-21)8-16(7-14)11-21)22-19(26)12-25-20(27)17-4-2-3-5-18(17)23-24-25/h2-5,13-16H,6-12H2,1H3,(H,22,26)/t13-,14?,15?,16?,21?/m1/s1