N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide

Systemtic Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-(6-nitro-4-oxidanylidene-quinazolin-3-yl)ethanamide Openeye Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-(6-nitro-4-oxo-quinazolin-3-yl)acetamide CAS Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-(6-nitro-4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-(6-nitro-4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-(4-keto-6-nitro-quinazolin-3-yl)acetamide Formula: C19H16N4O6 MolecularWeight: 396.35354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC2=C(C=C1)OCO2)NC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O6/c1-11(12-2-5-16-17(6-12)29-10-28-16)21-18(24)8-22-9-20-15-4-3-13(23(26)27)7-14(15)19(22)25/h2-7,9,11H,8,10H2,1H3,(H,21,24)/t11-/m1/s1