ethyl 5-(4-chlorophenyl)-1-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonylamino)-2-methyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(4-chlorophenyl)-1-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonylamino)-2-methyl-pyrrole-3-carboxylate Openeye Name: ethyl 5-(4-chlorophenyl)-1-(2,3-dihydro-1,4-benzodioxine-3-carbonylamino)-2-methyl-pyrrole-3-carboxylate CAS Name: 5-(4-chlorophenyl)-1-[[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]amino]-2-methyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorophenyl)-1-(2,3-dihydro-1,4-benzodioxine-3-carbonylamino)-2-methylpyrrole-3-carboxylate Traditional Name: 5-(4-chlorophenyl)-1-(2,3-dihydro-1,4-benzodioxin-3-carbonylamino)-2-methyl-pyrrole-3-carboxylic acid ethyl ester Formula: C23H21ClN2O5 MolecularWeight: 440.87624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)Cl)NC(=O)C3COC4=CC=CC=C4O3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)Cl)NC(=O)C3COC4=CC=CC=C4O3)C

InChI

InChI=1S/C23H21ClN2O5/c1-3-29-23(28)17-12-18(15-8-10-16(24)11-9-15)26(14(17)2)25-22(27)21-13-30-19-6-4-5-7-20(19)31-21/h4-12,21H,3,13H2,1-2H3,(H,25,27)