(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate

Systemtic Name: (8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Openeye Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl (E)-3-(5-nitro-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-nitro-2-furanyl)-2-propenoic acid (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-nitro-2-furyl)acrylic acid (4-keto-8-methyl-1H-quinazolin-2-yl)methyl ester Formula: C17H13N3O6 MolecularWeight: 355.30162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)C=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)/C=C/C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O6/c1-10-3-2-4-12-16(10)18-13(19-17(12)22)9-25-15(21)8-6-11-5-7-14(26-11)20(23)24/h2-8H,9H2,1H3,(H,18,19,22)/b8-6+