3-(dipropylcarbamoyl)-5-pyrrolidin-1-ylsulfonyl-benzoic acid

Systemtic Name: 3-(dipropylcarbamoyl)-5-pyrrolidin-1-ylsulfonyl-benzoic acid Openeye Name: 3-(dipropylcarbamoyl)-5-pyrrolidin-1-ylsulfonyl-benzoic acid CAS Name: 3-[(dipropylamino)-oxomethyl]-5-(1-pyrrolidinylsulfonyl)benzoic acid IUPAC Name: 3-(dipropylcarbamoyl)-5-pyrrolidin-1-ylsulfonylbenzoic acid Traditional Name: 3-(dipropylcarbamoyl)-5-pyrrolidinosulfonyl-benzoic acid Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=CC(=C1)S(=O)(=O)N2CCCC2)C(=O)O

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=CC(=C1)S(=O)(=O)N2CCCC2)C(=O)O

InChI

InChI=1S/C18H26N2O5S/c1-3-7-19(8-4-2)17(21)14-11-15(18(22)23)13-16(12-14)26(24,25)20-9-5-6-10-20/h11-13H,3-10H2,1-2H3,(H,22,23)