2-[1-[2-[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]ethyl]indol-4-yl]oxypropanoic acid

Systemtic Name: 2-[1-[2-[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]ethyl]indol-4-yl]oxypropanoic acid Openeye Name: 2-[1-[2-[[2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]indol-4-yl]oxypropanoic acid CAS Name: 2-[[1-[2-[[2-hydroxy-2-(3-pyridinyl)ethyl]amino]ethyl]-4-indolyl]oxy]propanoic acid IUPAC Name: 2-[1-[2-[(2-hydroxy-2-pyridin-3-ylethyl)amino]ethyl]indol-4-yl]oxypropanoic acid Traditional Name: 2-[1-[2-[[2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]indol-4-yl]oxypropionic acid Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=CC2=C1C=CN2CCNCC(C3=CN=CC=C3)O

Isomeric SMILES

CC(C(=O)O)OC1=CC=CC2=C1C=CN2CCNCC(C3=CN=CC=C3)O

InChI

InChI=1S/C20H23N3O4/c1-14(20(25)26)27-19-6-2-5-17-16(19)7-10-23(17)11-9-22-13-18(24)15-4-3-8-21-12-15/h2-8,10,12,14,18,22,24H,9,11,13H2,1H3,(H,25,26)