2-[[(2R)-6,7-bis(chloranyl)-2-methyl-1-oxidanylidene-2-phenyl-3H-inden-5-yl]oxy]ethanoate; 1-phenylethylazanium

Systemtic Name: 2-[[(2R)-6,7-bis(chloranyl)-2-methyl-1-oxidanylidene-2-phenyl-3H-inden-5-yl]oxy]ethanoate; 1-phenylethylazanium Openeye Name: 2-[(2R)-6,7-dichloro-2-methyl-1-oxo-2-phenyl-indan-5-yl]oxyacetate; 1-phenylethylammonium CAS Name: 2-[[(2R)-6,7-dichloro-2-methyl-1-oxo-2-phenyl-3H-inden-5-yl]oxy]acetate; 1-phenylethylammonium IUPAC Name: 2-[[(2R)-6,7-dichloro-2-methyl-1-oxo-2-phenyl-3H-inden-5-yl]oxy]acetate; 1-phenylethylazanium Traditional Name: 2-[(2R)-6,7-dichloro-1-keto-2-methyl-2-phenyl-indan-5-yl]oxyacetate; 1-phenylethylammonium Formula: C26H25Cl2NO4 MolecularWeight: 486.387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH3+].CC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCC(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=CC=C1)[NH3+].C[C@@]1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCC(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H14Cl2O4.C8H11N/c1-18(11-5-3-2-4-6-11)8-10-7-12(24-9-13(21)22)15(19)16(20)14(10)17(18)23;1-7(9)8-5-3-2-4-6-8/h2-7H,8-9H2,1H3,(H,21,22);2-7H,9H2,1H3/t18-;/m1./s1