N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanamide

Systemtic Name: N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanamide Openeye Name: N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide CAS Name: N-[[[(1S,2S)-2-methylcyclohexyl]amino]-oxomethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide IUPAC Name: N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide Traditional Name: 2-(4-keto-1,2,3-benzotriazin-3-yl)-N-[[(1S,2S)-2-methylcyclohexyl]carbamoyl]acetamide Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)NC(=O)CN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)NC(=O)CN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H21N5O3/c1-11-6-2-4-8-13(11)18-17(25)19-15(23)10-22-16(24)12-7-3-5-9-14(12)20-21-22/h3,5,7,9,11,13H,2,4,6,8,10H2,1H3,(H2,18,19,23,25)/t11-,13-/m0/s1