(2S)-2-azanyl-3-[4-[bis(2-hydroxyethyl)amino]phenyl]propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[4-[bis(2-hydroxyethyl)amino]phenyl]propanoic acid Openeye Name: (2S)-2-amino-3-[4-[bis(2-hydroxyethyl)amino]phenyl]propanoic acid CAS Name: (2S)-2-amino-3-[4-[bis(2-hydroxyethyl)amino]phenyl]propanoic acid IUPAC Name: (2S)-2-amino-3-[4-[bis(2-hydroxyethyl)amino]phenyl]propanoic acid Traditional Name: (2S)-2-amino-3-[4-[bis(2-hydroxyethyl)amino]phenyl]propionic acid Formula: C13H20N2O4 MolecularWeight: 268.3089

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)N)N(CCO)CCO

Isomeric SMILES

C1=CC(=CC=C1C[C@@H](C(=O)O)N)N(CCO)CCO

InChI

InChI=1S/C13H20N2O4/c14-12(13(18)19)9-10-1-3-11(4-2-10)15(5-7-16)6-8-17/h1-4,12,16-17H,5-9,14H2,(H,18,19)/t12-/m0/s1