2-azanyl-3-[4-[2,6-bis(azanyl)hexanoyloxy]phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[4-[2,6-bis(azanyl)hexanoyloxy]phenyl]propanoic acid Openeye Name: 2-amino-3-[4-(2,6-diaminohexanoyloxy)phenyl]propanoic acid CAS Name: 2-amino-3-[4-(2,6-diamino-1-oxohexoxy)phenyl]propanoic acid IUPAC Name: 2-amino-3-[4-(2,6-diaminohexanoyloxy)phenyl]propanoic acid Traditional Name: 2-amino-3-[4-(2,6-diaminohexanoyloxy)phenyl]propionic acid Formula: C15H23N3O4 MolecularWeight: 309.36082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)N)OC(=O)C(CCCCN)N

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)N)OC(=O)C(CCCCN)N

InChI

InChI=1S/C15H23N3O4/c16-8-2-1-3-12(17)15(21)22-11-6-4-10(5-7-11)9-13(18)14(19)20/h4-7,12-13H,1-3,8-9,16-18H2,(H,19,20)