3-[[4-[(3-acetamido-4-methoxy-phenyl)sulfonylamino]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[(3-acetamido-4-methoxy-phenyl)sulfonylamino]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[(3-acetamido-4-methoxy-phenyl)sulfonylamino]benzoyl]amino]propanoic acid CAS Name: 3-[[[4-[(3-acetamido-4-methoxyphenyl)sulfonylamino]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[4-[(3-acetamido-4-methoxyphenyl)sulfonylamino]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[(3-acetamido-4-methoxy-phenyl)sulfonylamino]benzoyl]amino]propionic acid Formula: C19H21N3O7S MolecularWeight: 435.45094

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NCCC(=O)O)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NCCC(=O)O)OC

InChI

InChI=1S/C19H21N3O7S/c1-12(23)21-16-11-15(7-8-17(16)29-2)30(27,28)22-14-5-3-13(4-6-14)19(26)20-10-9-18(24)25/h3-8,11,22H,9-10H2,1-2H3,(H,20,26)(H,21,23)(H,24,25)