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

Systemtic Name: 2-[1-(2-azanyl-2-oxidanylidene-ethyl)-3-[(3-chlorophenyl)methyl]-2-ethyl-indolizin-8-yl]oxyethanoic acid Openeye Name: 2-[1-(2-amino-2-oxo-ethyl)-3-[(3-chlorophenyl)methyl]-2-ethyl-indolizin-8-yl]oxyacetic acid CAS Name: 2-[[1-(2-amino-2-oxoethyl)-3-[(3-chlorophenyl)methyl]-2-ethyl-8-indolizinyl]oxy]acetic acid IUPAC Name: 2-[1-(2-amino-2-oxoethyl)-3-[(3-chlorophenyl)methyl]-2-ethylindolizin-8-yl]oxyacetic acid Traditional Name: 2-[1-(2-amino-2-keto-ethyl)-3-(3-chlorobenzyl)-2-ethyl-indolizin-8-yl]oxyacetic acid Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN2O4/c1-2-15-16(11-19(23)25)21-18(28-12-20(26)27)7-4-8-24(21)17(15)10-13-5-3-6-14(22)9-13/h3-9H,2,10-12H2,1H3,(H2,23,25)(H,26,27)