N-methyl-2-[(5-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-methyl-2-[(5-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-methyl-2-[(5-nitro-2-oxo-1,3-benzoxazol-3-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-methyl-2-[(5-nitro-2-oxo-1,3-benzoxazol-3-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-methyl-2-[(5-nitro-2-oxo-1,3-benzoxazol-3-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[(2-keto-5-nitro-1,3-benzoxazol-3-yl)methyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C19H18N4O5 MolecularWeight: 382.37002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC2=CC=CC=C2CN1CN3C4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

CNC(=O)C1CC2=CC=CC=C2CN1CN3C4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C19H18N4O5/c1-20-18(24)16-8-12-4-2-3-5-13(12)10-21(16)11-22-15-9-14(23(26)27)6-7-17(15)28-19(22)25/h2-7,9,16H,8,10-11H2,1H3,(H,20,24)