2-[[3-(2-azanyl-2-oxidanylidene-ethyl)-2-ethyl-1-(phenylmethyl)-3H-inden-4-yl]oxy]ethanoic acid

Systemtic Name: 2-[[3-(2-azanyl-2-oxidanylidene-ethyl)-2-ethyl-1-(phenylmethyl)-3H-inden-4-yl]oxy]ethanoic acid Openeye Name: 2-[[3-(2-amino-2-oxo-ethyl)-1-benzyl-2-ethyl-3H-inden-4-yl]oxy]acetic acid CAS Name: 2-[[3-(2-amino-2-oxoethyl)-2-ethyl-1-(phenylmethyl)-3H-inden-4-yl]oxy]acetic acid IUPAC Name: 2-[[3-(2-amino-2-oxoethyl)-1-benzyl-2-ethyl-3H-inden-4-yl]oxy]acetic acid Traditional Name: 2-[[3-(2-amino-2-keto-ethyl)-1-benzyl-2-ethyl-3H-inden-4-yl]oxy]acetic acid Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO4/c1-2-15-17(11-14-7-4-3-5-8-14)16-9-6-10-19(27-13-21(25)26)22(16)18(15)12-20(23)24/h3-10,18H,2,11-13H2,1H3,(H2,23,24)(H,25,26)