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

Systemtic Name: 2-[1-[2-(dimethylamino)-2-oxidanylidene-ethanoyl]-2-ethyl-3-(phenylmethyl)indolizin-8-yl]oxyethanoic acid Openeye Name: 2-[3-benzyl-1-[2-(dimethylamino)-2-oxo-acetyl]-2-ethyl-indolizin-8-yl]oxyacetic acid CAS Name: 2-[[1-[2-(dimethylamino)-1,2-dioxoethyl]-2-ethyl-3-(phenylmethyl)-8-indolizinyl]oxy]acetic acid IUPAC Name: 2-[3-benzyl-1-[2-(dimethylamino)-2-oxoacetyl]-2-ethylindolizin-8-yl]oxyacetic acid Traditional Name: 2-[3-benzyl-1-[2-(dimethylamino)-2-keto-acetyl]-2-ethyl-indolizin-8-yl]oxyacetic acid Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C=CC=C(C2=C1C(=O)C(=O)N(C)C)OCC(=O)O)CC3=CC=CC=C3

Isomeric SMILES

CCC1=C(N2C=CC=C(C2=C1C(=O)C(=O)N(C)C)OCC(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C23H24N2O5/c1-4-16-17(13-15-9-6-5-7-10-15)25-12-8-11-18(30-14-19(26)27)21(25)20(16)22(28)23(29)24(2)3/h5-12H,4,13-14H2,1-3H3,(H,26,27)