N-(4-methoxy-2-nitro-phenyl)-3-(4-oxidanylidene-[1]benzofuro[3,2-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-3-(4-oxidanylidene-[1]benzofuro[3,2-d]pyrimidin-3-yl)propanamide Openeye Name: N-(4-methoxy-2-nitro-phenyl)-3-(4-oxobenzofuro[3,2-d]pyrimidin-3-yl)propanamide CAS Name: N-(4-methoxy-2-nitrophenyl)-3-(4-oxo-3-benzofuro[3,2-d]pyrimidinyl)propanamide IUPAC Name: N-(4-methoxy-2-nitrophenyl)-3-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)propanamide Traditional Name: 3-(4-ketobenzofuro[3,2-d]pyrimidin-3-yl)-N-(4-methoxy-2-nitro-phenyl)propionamide Formula: C20H16N4O6 MolecularWeight: 408.36424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CCN2C=NC3=C(C2=O)OC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CCN2C=NC3=C(C2=O)OC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C20H16N4O6/c1-29-12-6-7-14(15(10-12)24(27)28)22-17(25)8-9-23-11-21-18-13-4-2-3-5-16(13)30-19(18)20(23)26/h2-7,10-11H,8-9H2,1H3,(H,22,25)