1-[3-(3-aminophenyl)-2-(naphthalen-2-ylsulfonylamino)propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-(3-aminophenyl)-2-(naphthalen-2-ylsulfonylamino)propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[3-(3-aminophenyl)-2-(2-naphthylsulfonylamino)propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(3-aminophenyl)-2-(2-naphthalenylsulfonylamino)-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-(3-aminophenyl)-2-(naphthalen-2-ylsulfonylamino)propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(3-aminophenyl)-2-(2-naphthylsulfonylamino)propanoyl]proline Formula: C24H25N3O5S MolecularWeight: 467.5374

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CC(=CC=C2)N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C(CC2=CC(=CC=C2)N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C(=O)O

InChI

InChI=1S/C24H25N3O5S/c25-19-8-3-5-16(13-19)14-21(23(28)27-12-4-9-22(27)24(29)30)26-33(31,32)20-11-10-17-6-1-2-7-18(17)15-20/h1-3,5-8,10-11,13,15,21-22,26H,4,9,12,14,25H2,(H,29,30)