2-[[3-[(3-aminophenyl)carbonylamino]phenyl]sulfonylamino]butanedioic acid

Systemtic Name: 2-[[3-[(3-aminophenyl)carbonylamino]phenyl]sulfonylamino]butanedioic acid Openeye Name: 2-[[3-[(3-aminobenzoyl)amino]phenyl]sulfonylamino]butanedioic acid CAS Name: 2-[[3-[[(3-aminophenyl)-oxomethyl]amino]phenyl]sulfonylamino]butanedioic acid IUPAC Name: 2-[[3-[(3-aminobenzoyl)amino]phenyl]sulfonylamino]butanedioic acid Traditional Name: 2-[[3-[(3-aminobenzoyl)amino]phenyl]sulfonylamino]succinic acid Formula: C17H17N3O7S MolecularWeight: 407.39778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)C(=O)NC2=CC(=CC=C2)S(=O)(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N)C(=O)NC2=CC(=CC=C2)S(=O)(=O)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C17H17N3O7S/c18-11-4-1-3-10(7-11)16(23)19-12-5-2-6-13(8-12)28(26,27)20-14(17(24)25)9-15(21)22/h1-8,14,20H,9,18H2,(H,19,23)(H,21,22)(H,24,25)