3-[(4-bromophenyl)amino]-2-(3,4-dimethoxyphenyl)inden-1-one

Systemtic Name: 3-[(4-bromophenyl)amino]-2-(3,4-dimethoxyphenyl)inden-1-one Openeye Name: 3-(4-bromoanilino)-2-(3,4-dimethoxyphenyl)inden-1-one CAS Name: 3-(4-bromoanilino)-2-(3,4-dimethoxyphenyl)-1-indenone IUPAC Name: 3-(4-bromoanilino)-2-(3,4-dimethoxyphenyl)inden-1-one Traditional Name: 3-(4-bromoanilino)-2-(3,4-dimethoxyphenyl)inden-1-one Formula: C23H18BrNO3 MolecularWeight: 436.29792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C3=CC=CC=C3C2=O)NC4=CC=C(C=C4)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C3=CC=CC=C3C2=O)NC4=CC=C(C=C4)Br)OC

InChI

InChI=1S/C23H18BrNO3/c1-27-19-12-7-14(13-20(19)28-2)21-22(25-16-10-8-15(24)9-11-16)17-5-3-4-6-18(17)23(21)26/h3-13,25H,1-2H3