[(2-aminophenyl)carbonylamino] 2-(butylsulfonylamino)-3-phenyl-propanoate

Systemtic Name: [(2-aminophenyl)carbonylamino] 2-(butylsulfonylamino)-3-phenyl-propanoate Openeye Name: [(2-aminobenzoyl)amino] 2-(butylsulfonylamino)-3-phenyl-propanoate CAS Name: 2-(butylsulfonylamino)-3-phenylpropanoic acid [[(2-aminophenyl)-oxomethyl]amino] ester IUPAC Name: [(2-aminobenzoyl)amino] 2-(butylsulfonylamino)-3-phenylpropanoate Traditional Name: 2-(butylsulfonylamino)-3-phenyl-propionic acid (anthraniloylamino) ester Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(CC1=CC=CC=C1)C(=O)ONC(=O)C2=CC=CC=C2N

Isomeric SMILES

CCCCS(=O)(=O)NC(CC1=CC=CC=C1)C(=O)ONC(=O)C2=CC=CC=C2N

InChI

InChI=1S/C20H25N3O5S/c1-2-3-13-29(26,27)23-18(14-15-9-5-4-6-10-15)20(25)28-22-19(24)16-11-7-8-12-17(16)21/h4-12,18,23H,2-3,13-14,21H2,1H3,(H,22,24)