(4-aminocarbonyl-2-nitro-phenyl)methyl 2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: 2-methyl-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: 2-methyl-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C18H16N2O7 MolecularWeight: 372.32884

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=CC=CC=C2O1)C(=O)OCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1C(OC2=CC=CC=C2O1)C(=O)OCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O7/c1-10-16(27-15-5-3-2-4-14(15)26-10)18(22)25-9-12-7-6-11(17(19)21)8-13(12)20(23)24/h2-8,10,16H,9H2,1H3,(H2,19,21)