2-[1-(2-azanyl-2-oxidanylidene-ethyl)-2-ethyl-3-(phenylmethyl)indolizin-8-yl]oxyethanoic acid

Systemtic Name: 2-[1-(2-azanyl-2-oxidanylidene-ethyl)-2-ethyl-3-(phenylmethyl)indolizin-8-yl]oxyethanoic acid Openeye Name: 2-[1-(2-amino-2-oxo-ethyl)-3-benzyl-2-ethyl-indolizin-8-yl]oxyacetic acid CAS Name: 2-[[1-(2-amino-2-oxoethyl)-2-ethyl-3-(phenylmethyl)-8-indolizinyl]oxy]acetic acid IUPAC Name: 2-[1-(2-amino-2-oxoethyl)-3-benzyl-2-ethylindolizin-8-yl]oxyacetic acid Traditional Name: 2-[1-(2-amino-2-keto-ethyl)-3-benzyl-2-ethyl-indolizin-8-yl]oxyacetic acid Formula: C21H22N2O4 MolecularWeight: 366.41038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C=CC=C(C2=C1CC(=O)N)OCC(=O)O)CC3=CC=CC=C3

Isomeric SMILES

CCC1=C(N2C=CC=C(C2=C1CC(=O)N)OCC(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4/c1-2-15-16(12-19(22)24)21-18(27-13-20(25)26)9-6-10-23(21)17(15)11-14-7-4-3-5-8-14/h3-10H,2,11-13H2,1H3,(H2,22,24)(H,25,26)