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

Systemtic Name: ethyl 3,5-dimethyl-4-[2-[2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoyloxy]ethanoyl]-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3,5-dimethyl-4-[2-[2-(3-oxo-1,4-benzoxazin-4-yl)acetyl]oxyacetyl]-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[1-oxo-2-[1-oxo-2-(3-oxo-1,4-benzoxazin-4-yl)ethoxy]ethyl]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-[2-[2-(3-oxo-1,4-benzoxazin-4-yl)acetyl]oxyacetyl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[2-(3-keto-1,4-benzoxazin-4-yl)acetyl]oxyacetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C21H22N2O7 MolecularWeight: 414.40858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)COC(=O)CN2C(=O)COC3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)COC(=O)CN2C(=O)COC3=CC=CC=C32)C

InChI

InChI=1S/C21H22N2O7/c1-4-28-21(27)20-12(2)19(13(3)22-20)15(24)10-30-18(26)9-23-14-7-5-6-8-16(14)29-11-17(23)25/h5-8,22H,4,9-11H2,1-3H3