1-[3-[3,4-bis(fluoranyl)phenyl]carbonyl-6-methoxy-indol-1-yl]-3,3-dimethyl-butan-2-one

Systemtic Name: 1-[3-[3,4-bis(fluoranyl)phenyl]carbonyl-6-methoxy-indol-1-yl]-3,3-dimethyl-butan-2-one Openeye Name: 1-[3-(3,4-difluorobenzoyl)-6-methoxy-indol-1-yl]-3,3-dimethyl-butan-2-one CAS Name: 1-[3-[(3,4-difluorophenyl)-oxomethyl]-6-methoxy-1-indolyl]-3,3-dimethyl-2-butanone IUPAC Name: 1-[3-(3,4-difluorobenzoyl)-6-methoxyindol-1-yl]-3,3-dimethylbutan-2-one Traditional Name: 1-[3-(3,4-difluorobenzoyl)-6-methoxy-indol-1-yl]-3,3-dimethyl-butan-2-one Formula: C22H21F2NO3 MolecularWeight: 385.403846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C=C(C2=C1C=C(C=C2)OC)C(=O)C3=CC(=C(C=C3)F)F

Isomeric SMILES

CC(C)(C)C(=O)CN1C=C(C2=C1C=C(C=C2)OC)C(=O)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C22H21F2NO3/c1-22(2,3)20(26)12-25-11-16(15-7-6-14(28-4)10-19(15)25)21(27)13-5-8-17(23)18(24)9-13/h5-11H,12H2,1-4H3