2-[(1-butylsulfonylpyrrolidin-2-yl)carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(1-butylsulfonylpyrrolidin-2-yl)carbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[(1-butylsulfonylpyrrolidine-2-carbonyl)amino]-3-phenyl-propanoic acid CAS Name: 2-[[(1-butylsulfonyl-2-pyrrolidinyl)-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[(1-butylsulfonylpyrrolidine-2-carbonyl)amino]-3-phenylpropanoic acid Traditional Name: 2-[(1-butylsulfonylprolyl)amino]-3-phenyl-propionic acid Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCCC1C(=O)NC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCS(=O)(=O)N1CCCC1C(=O)NC(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H26N2O5S/c1-2-3-12-26(24,25)20-11-7-10-16(20)17(21)19-15(18(22)23)13-14-8-5-4-6-9-14/h4-6,8-9,15-16H,2-3,7,10-13H2,1H3,(H,19,21)(H,22,23)