ethyl 3-[(1,2,5-trimethyl-4-piperidin-1-ylcarbonyl-pyrrol-3-yl)sulfonylamino]benzoate

Systemtic Name: ethyl 3-[(1,2,5-trimethyl-4-piperidin-1-ylcarbonyl-pyrrol-3-yl)sulfonylamino]benzoate Openeye Name: ethyl 3-[[1,2,5-trimethyl-4-(piperidine-1-carbonyl)pyrrol-3-yl]sulfonylamino]benzoate CAS Name: 3-[[1,2,5-trimethyl-4-[oxo(1-piperidinyl)methyl]-3-pyrrolyl]sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[1,2,5-trimethyl-4-(piperidine-1-carbonyl)pyrrol-3-yl]sulfonylamino]benzoate Traditional Name: 3-[[1,2,5-trimethyl-4-(piperidine-1-carbonyl)pyrrol-3-yl]sulfonylamino]benzoic acid ethyl ester Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=C(N(C(=C2C(=O)N3CCCCC3)C)C)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=C(N(C(=C2C(=O)N3CCCCC3)C)C)C

InChI

InChI=1S/C22H29N3O5S/c1-5-30-22(27)17-10-9-11-18(14-17)23-31(28,29)20-16(3)24(4)15(2)19(20)21(26)25-12-7-6-8-13-25/h9-11,14,23H,5-8,12-13H2,1-4H3