3-[[3-(1-azanyl-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl)imidazo[4,5-b]pyridin-2-yl]amino]propanoic acid

Systemtic Name: 3-[[3-(1-azanyl-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl)imidazo[4,5-b]pyridin-2-yl]amino]propanoic acid Openeye Name: 3-[[3-[2-amino-1-(2-naphthylmethyl)-2-oxo-ethyl]imidazo[4,5-b]pyridin-2-yl]amino]propanoic acid CAS Name: 3-[[3-[1-amino-3-(2-naphthalenyl)-1-oxopropan-2-yl]-2-imidazo[4,5-b]pyridinyl]amino]propanoic acid IUPAC Name: 3-[[3-(1-amino-3-naphthalen-2-yl-1-oxopropan-2-yl)imidazo[4,5-b]pyridin-2-yl]amino]propanoic acid Traditional Name: 3-[[3-[2-amino-2-keto-1-(2-naphthylmethyl)ethyl]imidazo[4,5-b]pyridin-2-yl]amino]propionic acid Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CC(C(=O)N)N3C4=C(C=CC=N4)N=C3NCCC(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CC(C(=O)N)N3C4=C(C=CC=N4)N=C3NCCC(=O)O

InChI

InChI=1S/C22H21N5O3/c23-20(30)18(13-14-7-8-15-4-1-2-5-16(15)12-14)27-21-17(6-3-10-24-21)26-22(27)25-11-9-19(28)29/h1-8,10,12,18H,9,11,13H2,(H2,23,30)(H,25,26)(H,28,29)