2-(3,4-dihydro-2H-chromen-6-yl)-2-methyl-3-[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]propanoic acid

Systemtic Name: 2-(3,4-dihydro-2H-chromen-6-yl)-2-methyl-3-[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]propanoic acid Openeye Name: 2-chroman-6-yl-3-[[2-hydroxy-2-(3-pyridyl)ethyl]amino]-2-methyl-propanoic acid CAS Name: 2-(3,4-dihydro-2H-1-benzopyran-6-yl)-3-[[2-hydroxy-2-(3-pyridinyl)ethyl]amino]-2-methylpropanoic acid IUPAC Name: 2-(3,4-dihydro-2H-chromen-6-yl)-3-[(2-hydroxy-2-pyridin-3-ylethyl)amino]-2-methylpropanoic acid Traditional Name: 2-chroman-6-yl-3-[[2-hydroxy-2-(3-pyridyl)ethyl]amino]-2-methyl-propionic acid Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNCC(C1=CN=CC=C1)O)(C2=CC3=C(C=C2)OCCC3)C(=O)O

Isomeric SMILES

CC(CNCC(C1=CN=CC=C1)O)(C2=CC3=C(C=C2)OCCC3)C(=O)O

InChI

InChI=1S/C20H24N2O4/c1-20(19(24)25,13-22-12-17(23)15-4-2-8-21-11-15)16-6-7-18-14(10-16)5-3-9-26-18/h2,4,6-8,10-11,17,22-23H,3,5,9,12-13H2,1H3,(H,24,25)