N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl]-3-oxidanylidene-2,4-dihydroquinoxaline-1-carboxamide

Systemtic Name: N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl]-3-oxidanylidene-2,4-dihydroquinoxaline-1-carboxamide Openeye Name: N-[(1S)-2-(1,3-benzodioxol-5-ylmethylamino)-1-methyl-2-oxo-ethyl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide CAS Name: N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxopropan-2-yl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide IUPAC Name: N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxopropan-2-yl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide Traditional Name: 3-keto-N-[(1S)-2-keto-1-methyl-2-(piperonylamino)ethyl]-2,4-dihydroquinoxaline-1-carboxamide Formula: C20H20N4O5 MolecularWeight: 396.3966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)NC(=O)N3CC(=O)NC4=CC=CC=C43

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC2=C(C=C1)OCO2)NC(=O)N3CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C20H20N4O5/c1-12(19(26)21-9-13-6-7-16-17(8-13)29-11-28-16)22-20(27)24-10-18(25)23-14-4-2-3-5-15(14)24/h2-8,12H,9-11H2,1H3,(H,21,26)(H,22,27)(H,23,25)/t12-/m0/s1