N-[4a-(hydroxymethyl)-3-oxidanylidene-2,4,5,6-tetrahydrobenzo[h]cinnolin-8-yl]ethanamide

Systemtic Name: N-[4a-(hydroxymethyl)-3-oxidanylidene-2,4,5,6-tetrahydrobenzo[h]cinnolin-8-yl]ethanamide Openeye Name: N-[4a-(hydroxymethyl)-3-oxo-2,4,5,6-tetrahydrobenzo[h]cinnolin-8-yl]acetamide CAS Name: N-[4a-(hydroxymethyl)-3-oxo-2,4,5,6-tetrahydrobenzo[h]cinnolin-8-yl]acetamide IUPAC Name: N-[4a-(hydroxymethyl)-3-oxo-2,4,5,6-tetrahydrobenzo[h]cinnolin-8-yl]acetamide Traditional Name: N-(3-keto-4a-methylol-2,4,5,6-tetrahydrobenzo[h]cinnolin-8-yl)acetamide Formula: C15H17N3O3 MolecularWeight: 287.31378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C3=NNC(=O)CC3(CC2)CO

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C3=NNC(=O)CC3(CC2)CO

InChI

InChI=1S/C15H17N3O3/c1-9(20)16-11-2-3-12-10(6-11)4-5-15(8-19)7-13(21)17-18-14(12)15/h2-3,6,19H,4-5,7-8H2,1H3,(H,16,20)(H,17,21)