(2-nitrophenyl)methyl 4-(furan-2-ylcarbonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate

Systemtic Name: (2-nitrophenyl)methyl 4-(furan-2-ylcarbonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate Openeye Name: (2-nitrophenyl)methyl 4-(furan-2-carbonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate CAS Name: 4-[2-furanyl(oxo)methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 4-(furan-2-carbonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate Traditional Name: 4-(2-furoyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid (2-nitrobenzyl) ester Formula: C21H16N2O7 MolecularWeight: 408.36094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2N1C(=O)C3=CC=CO3)C(=O)OCC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1C(OC2=CC=CC=C2N1C(=O)C3=CC=CO3)C(=O)OCC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H16N2O7/c24-20(18-10-5-11-28-18)22-12-19(30-17-9-4-3-8-16(17)22)21(25)29-13-14-6-1-2-7-15(14)23(26)27/h1-11,19H,12-13H2