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

Systemtic Name: 3-[[4-[(aminocarbonylamino)methyl]phenyl]carbonylamino]butanoic acid Openeye Name: 3-[[4-(ureidomethyl)benzoyl]amino]butanoic acid CAS Name: 3-[[[4-[(carbamoylamino)methyl]phenyl]-oxomethyl]amino]butanoic acid IUPAC Name: 3-[[4-[(carbamoylamino)methyl]benzoyl]amino]butanoic acid Traditional Name: 3-[[4-(ureidomethyl)benzoyl]amino]butyric acid Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O4/c1-8(6-11(17)18)16-12(19)10-4-2-9(3-5-10)7-15-13(14)20/h2-5,8H,6-7H2,1H3,(H,16,19)(H,17,18)(H3,14,15,20)