2-[[4-(aminocarbonylamino)phenyl]carbonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[[4-(aminocarbonylamino)phenyl]carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: 3-hydroxy-2-[(4-ureidobenzoyl)amino]butanoic acid CAS Name: 2-[[[4-(carbamoylamino)phenyl]-oxomethyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-[[4-(carbamoylamino)benzoyl]amino]-3-hydroxybutanoic acid Traditional Name: 3-hydroxy-2-[(4-ureidobenzoyl)amino]butyric acid Formula: C12H15N3O5 MolecularWeight: 281.2646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C1=CC=C(C=C1)NC(=O)N)O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)C1=CC=C(C=C1)NC(=O)N)O

InChI

InChI=1S/C12H15N3O5/c1-6(16)9(11(18)19)15-10(17)7-2-4-8(5-3-7)14-12(13)20/h2-6,9,16H,1H3,(H,15,17)(H,18,19)(H3,13,14,20)