ethyl 2,5-dimethyl-4-[2-(5-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[2-(5-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[2-(5-nitro-2-oxo-1,3-benzoxazol-3-yl)acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[2-(5-nitro-2-oxo-1,3-benzoxazol-3-yl)-1-oxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[2-(5-nitro-2-oxo-1,3-benzoxazol-3-yl)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-(2-keto-5-nitro-1,3-benzoxazol-3-yl)acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C18H17N3O7 MolecularWeight: 387.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)CN2C3=C(C=CC(=C3)[N+](=O)[O-])OC2=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)CN2C3=C(C=CC(=C3)[N+](=O)[O-])OC2=O)C)C

InChI

InChI=1S/C18H17N3O7/c1-4-27-17(23)16-10(3)19-9(2)15(16)13(22)8-20-12-7-11(21(25)26)5-6-14(12)28-18(20)24/h5-7,19H,4,8H2,1-3H3