6,7-bis(chloranyl)-5-methoxy-2-(3-oxidanylidenebutyl)-2-(phenylmethyl)-3H-inden-1-one

Systemtic Name: 6,7-bis(chloranyl)-5-methoxy-2-(3-oxidanylidenebutyl)-2-(phenylmethyl)-3H-inden-1-one Openeye Name: 2-benzyl-6,7-dichloro-5-methoxy-2-(3-oxobutyl)indan-1-one CAS Name: 6,7-dichloro-5-methoxy-2-(3-oxobutyl)-2-(phenylmethyl)-3H-inden-1-one IUPAC Name: 2-benzyl-6,7-dichloro-5-methoxy-2-(3-oxobutyl)-3H-inden-1-one Traditional Name: 2-benzyl-6,7-dichloro-2-(3-ketobutyl)-5-methoxy-indan-1-one Formula: C21H20Cl2O3 MolecularWeight: 391.2877

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OC)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)CCC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OC)CC3=CC=CC=C3

InChI

InChI=1S/C21H20Cl2O3/c1-13(24)8-9-21(11-14-6-4-3-5-7-14)12-15-10-16(26-2)18(22)19(23)17(15)20(21)25/h3-7,10H,8-9,11-12H2,1-2H3