ethyl 1-[4-[4-(3-ethoxycarbonyl-2,5-dimethyl-pyrrol-1-yl)phenyl]sulfonylphenyl]-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[4-[4-(3-ethoxycarbonyl-2,5-dimethyl-pyrrol-1-yl)phenyl]sulfonylphenyl]-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[4-[4-(3-ethoxycarbonyl-2,5-dimethyl-pyrrol-1-yl)phenyl]sulfonylphenyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-[4-[4-(3-ethoxycarbonyl-2,5-dimethyl-1-pyrrolyl)phenyl]sulfonylphenyl]-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[4-(3-ethoxycarbonyl-2,5-dimethylpyrrol-1-yl)phenyl]sulfonylphenyl]-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-[4-[4-(3-carbethoxy-2,5-dimethyl-pyrrol-1-yl)phenyl]sulfonylphenyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C30H32N2O6S MolecularWeight: 548.64988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C)C2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)N4C(=CC(=C4C)C(=O)OCC)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)C2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)N4C(=CC(=C4C)C(=O)OCC)C)C

InChI

InChI=1S/C30H32N2O6S/c1-7-37-29(33)27-17-19(3)31(21(27)5)23-9-13-25(14-10-23)39(35,36)26-15-11-24(12-16-26)32-20(4)18-28(22(32)6)30(34)38-8-2/h9-18H,7-8H2,1-6H3