3-[[3-(3-azanylpropylcarbamoylamino)phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[3-(3-azanylpropylcarbamoylamino)phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[3-(3-aminopropylcarbamoylamino)benzoyl]amino]propanoic acid CAS Name: 3-[[[3-[[(3-aminopropylamino)-oxomethyl]amino]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[3-(3-aminopropylcarbamoylamino)benzoyl]amino]propanoic acid Traditional Name: 3-[[3-(3-aminopropylcarbamoylamino)benzoyl]amino]propionic acid Formula: C14H20N4O4 MolecularWeight: 308.333

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NCCCN)C(=O)NCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NCCCN)C(=O)NCCC(=O)O

InChI

InChI=1S/C14H20N4O4/c15-6-2-7-17-14(22)18-11-4-1-3-10(9-11)13(21)16-8-5-12(19)20/h1,3-4,9H,2,5-8,15H2,(H,16,21)(H,19,20)(H2,17,18,22)