methyl 4-[(2,5-dimethyl-4-piperidin-1-ylcarbonyl-1H-pyrrol-3-yl)sulfonylamino]benzoate

Systemtic Name: methyl 4-[(2,5-dimethyl-4-piperidin-1-ylcarbonyl-1H-pyrrol-3-yl)sulfonylamino]benzoate Openeye Name: methyl 4-[[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonylamino]benzoate CAS Name: 4-[[2,5-dimethyl-4-[oxo(1-piperidinyl)methyl]-1H-pyrrol-3-yl]sulfonylamino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonylamino]benzoate Traditional Name: 4-[[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonylamino]benzoic acid methyl ester Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OC)C(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=C(N1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OC)C(=O)N3CCCCC3

InChI

InChI=1S/C20H25N3O5S/c1-13-17(19(24)23-11-5-4-6-12-23)18(14(2)21-13)29(26,27)22-16-9-7-15(8-10-16)20(25)28-3/h7-10,21-22H,4-6,11-12H2,1-3H3