3-[[3-[2,6-bis(azanyl)hexanoylamino]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[3-[2,6-bis(azanyl)hexanoylamino]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[3-(2,6-diaminohexanoylamino)benzoyl]amino]propanoic acid CAS Name: 3-[[[3-[(2,6-diamino-1-oxohexyl)amino]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[3-(2,6-diaminohexanoylamino)benzoyl]amino]propanoic acid Traditional Name: 3-[[3-(2,6-diaminohexanoylamino)benzoyl]amino]propionic acid Formula: C16H24N4O4 MolecularWeight: 336.38616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N4O4/c17-8-2-1-6-13(18)16(24)20-12-5-3-4-11(10-12)15(23)19-9-7-14(21)22/h3-5,10,13H,1-2,6-9,17-18H2,(H,19,23)(H,20,24)(H,21,22)