(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC(C3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC(C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C19H20N2O5S/c20-18(22)17(14-6-2-1-3-7-14)26-19(23)15-8-10-16(11-9-15)27(24,25)21-12-4-5-13-21/h1-3,6-11,17H,4-5,12-13H2,(H2,20,22)