1-methoxy-1-oxidanylidene-2-phenyl-4-pyrrolidin-1-yl-butane-2-sulfonic acid

Systemtic Name: 1-methoxy-1-oxidanylidene-2-phenyl-4-pyrrolidin-1-yl-butane-2-sulfonic acid Openeye Name: 1-methoxy-1-oxo-2-phenyl-4-pyrrolidin-1-yl-butane-2-sulfonic acid CAS Name: 1-methoxy-1-oxo-2-phenyl-4-(1-pyrrolidinyl)-2-butanesulfonic acid IUPAC Name: 1-methoxy-1-oxo-2-phenyl-4-pyrrolidin-1-ylbutane-2-sulfonic acid Traditional Name: 1-keto-1-methoxy-2-phenyl-4-pyrrolidino-butane-2-sulfonic acid Formula: C15H21NO5S MolecularWeight: 327.39594

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCN1CCCC1)(C2=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

COC(=O)C(CCN1CCCC1)(C2=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C15H21NO5S/c1-21-14(17)15(22(18,19)20,13-7-3-2-4-8-13)9-12-16-10-5-6-11-16/h2-4,7-8H,5-6,9-12H2,1H3,(H,18,19,20)