3-[[3-(6-azanylhexanoylamino)phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[3-(6-azanylhexanoylamino)phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[3-(6-aminohexanoylamino)benzoyl]amino]propanoic acid CAS Name: 3-[[[3-[(6-amino-1-oxohexyl)amino]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[3-(6-aminohexanoylamino)benzoyl]amino]propanoic acid Traditional Name: 3-[[3-(6-aminohexanoylamino)benzoyl]amino]propionic acid Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O4/c17-9-3-1-2-7-14(20)19-13-6-4-5-12(11-13)16(23)18-10-8-15(21)22/h4-6,11H,1-3,7-10,17H2,(H,18,23)(H,19,20)(H,21,22)