[2-[4-[methyl(methylsulfonyl)amino]phenyl]-2-oxidanylidene-ethyl] 4-pyrrol-1-ylbenzoate

Systemtic Name: [2-[4-[methyl(methylsulfonyl)amino]phenyl]-2-oxidanylidene-ethyl] 4-pyrrol-1-ylbenzoate Openeye Name: [2-[4-[methyl(methylsulfonyl)amino]phenyl]-2-oxo-ethyl] 4-pyrrol-1-ylbenzoate CAS Name: 4-(1-pyrrolyl)benzoic acid [2-[4-[methyl(methylsulfonyl)amino]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-[methyl(methylsulfonyl)amino]phenyl]-2-oxoethyl] 4-pyrrol-1-ylbenzoate Traditional Name: 4-pyrrol-1-ylbenzoic acid [2-keto-2-[4-[mesyl(methyl)amino]phenyl]ethyl] ester Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C=CC=C3)S(=O)(=O)C

Isomeric SMILES

CN(C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C21H20N2O5S/c1-22(29(2,26)27)18-9-5-16(6-10-18)20(24)15-28-21(25)17-7-11-19(12-8-17)23-13-3-4-14-23/h3-14H,15H2,1-2H3