[1-[4-chloranyl-1,3-bis(oxidanylidene)-2-phenyl-inden-2-yl]-2-methoxy-2-oxidanylidene-ethyl]-trimethyl-azanium

Systemtic Name: [1-[4-chloranyl-1,3-bis(oxidanylidene)-2-phenyl-inden-2-yl]-2-methoxy-2-oxidanylidene-ethyl]-trimethyl-azanium Openeye Name: [1-(4-chloro-1,3-dioxo-2-phenyl-indan-2-yl)-2-methoxy-2-oxo-ethyl]-trimethyl-ammonium CAS Name: [1-(4-chloro-1,3-dioxo-2-phenyl-2-indenyl)-2-methoxy-2-oxoethyl]-trimethylammonium IUPAC Name: [1-(4-chloro-1,3-dioxo-2-phenylinden-2-yl)-2-methoxy-2-oxoethyl]-trimethylazanium Traditional Name: [1-(4-chloro-1,3-diketo-2-phenyl-indan-2-yl)-2-keto-2-methoxy-ethyl]-trimethyl-ammonium Formula: C21H21ClNO4+ MolecularWeight: 386.84874

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C(C(=O)OC)C1(C(=O)C2=C(C1=O)C(=CC=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

C[N+](C)(C)C(C(=O)OC)C1(C(=O)C2=C(C1=O)C(=CC=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H21ClNO4/c1-23(2,3)17(20(26)27-4)21(13-9-6-5-7-10-13)18(24)14-11-8-12-15(22)16(14)19(21)25/h5-12,17H,1-4H3/q+1