3-[2-[2-(aminocarbonylamino)phenyl]ethanoylamino]-2-oxidanylidene-azetidine-1-sulfonic acid

Systemtic Name: 3-[2-[2-(aminocarbonylamino)phenyl]ethanoylamino]-2-oxidanylidene-azetidine-1-sulfonic acid Openeye Name: 2-oxo-3-[[2-(2-ureidophenyl)acetyl]amino]azetidine-1-sulfonic acid CAS Name: 3-[[2-[2-(carbamoylamino)phenyl]-1-oxoethyl]amino]-2-oxo-1-azetidinesulfonic acid IUPAC Name: 3-[[2-[2-(carbamoylamino)phenyl]acetyl]amino]-2-oxoazetidine-1-sulfonic acid Traditional Name: 2-keto-3-[[2-(2-ureidophenyl)acetyl]amino]azetidine-1-sulfonic acid Formula: C12H14N4O6S MolecularWeight: 342.32776

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N1S(=O)(=O)O)NC(=O)CC2=CC=CC=C2NC(=O)N

Isomeric SMILES

C1C(C(=O)N1S(=O)(=O)O)NC(=O)CC2=CC=CC=C2NC(=O)N

InChI

InChI=1S/C12H14N4O6S/c13-12(19)15-8-4-2-1-3-7(8)5-10(17)14-9-6-16(11(9)18)23(20,21)22/h1-4,9H,5-6H2,(H,14,17)(H3,13,15,19)(H,20,21,22)