(E)-3-[4-[2-(aminocarbonylamino)propanoylamino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[2-(aminocarbonylamino)propanoylamino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(2-ureidopropanoylamino)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[[2-(carbamoylamino)-1-oxopropyl]amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[2-(carbamoylamino)propanoylamino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(2-ureidopropanoylamino)phenyl]acrylic acid Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C=CC(=O)O)NC(=O)N

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)/C=C/C(=O)O)NC(=O)N

InChI

InChI=1S/C13H15N3O4/c1-8(15-13(14)20)12(19)16-10-5-2-9(3-6-10)4-7-11(17)18/h2-8H,1H3,(H,16,19)(H,17,18)(H3,14,15,20)/b7-4+