ethyl 4-(1,3-benzodioxol-5-yl)-3-[(2,5-dimethylfuran-3-yl)carbonylamino]-1-methyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-(1,3-benzodioxol-5-yl)-3-[(2,5-dimethylfuran-3-yl)carbonylamino]-1-methyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-(1,3-benzodioxol-5-yl)-3-[(2,5-dimethylfuran-3-carbonyl)amino]-1-methyl-pyrrole-2-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-3-[[(2,5-dimethyl-3-furanyl)-oxomethyl]amino]-1-methyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzodioxol-5-yl)-3-[(2,5-dimethylfuran-3-carbonyl)amino]-1-methylpyrrole-2-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-3-[(2,5-dimethyl-3-furoyl)amino]-1-methyl-pyrrole-2-carboxylic acid ethyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CN1C)C2=CC3=C(C=C2)OCO3)NC(=O)C4=C(OC(=C4)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CN1C)C2=CC3=C(C=C2)OCO3)NC(=O)C4=C(OC(=C4)C)C

InChI

InChI=1S/C22H22N2O6/c1-5-27-22(26)20-19(23-21(25)15-8-12(2)30-13(15)3)16(10-24(20)4)14-6-7-17-18(9-14)29-11-28-17/h6-10H,5,11H2,1-4H3,(H,23,25)