4-(3-bromanylphenoxy)-1-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]butan-1-one

Systemtic Name: 4-(3-bromanylphenoxy)-1-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]butan-1-one Openeye Name: 4-(3-bromophenoxy)-1-[4-(4-methoxybenzoyl)piperazin-1-yl]butan-1-one CAS Name: 4-(3-bromophenoxy)-1-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperazinyl]-1-butanone IUPAC Name: 4-(3-bromophenoxy)-1-[4-(4-methoxybenzoyl)piperazin-1-yl]butan-1-one Traditional Name: 4-(3-bromophenoxy)-1-(4-p-anisoylpiperazino)butan-1-one Formula: C22H25BrN2O4 MolecularWeight: 461.3489

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCCOC3=CC(=CC=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C22H25BrN2O4/c1-28-19-9-7-17(8-10-19)22(27)25-13-11-24(12-14-25)21(26)6-3-15-29-20-5-2-4-18(23)16-20/h2,4-5,7-10,16H,3,6,11-15H2,1H3