4-[[4-(4-bromophenyl)carbonylpiperazin-1-yl]methyl]-6-ethoxy-chromen-2-one

Systemtic Name: 4-[[4-(4-bromophenyl)carbonylpiperazin-1-yl]methyl]-6-ethoxy-chromen-2-one Openeye Name: 4-[[4-(4-bromobenzoyl)piperazin-1-yl]methyl]-6-ethoxy-chromen-2-one CAS Name: 4-[[4-[(4-bromophenyl)-oxomethyl]-1-piperazinyl]methyl]-6-ethoxy-1-benzopyran-2-one IUPAC Name: 4-[[4-(4-bromobenzoyl)piperazin-1-yl]methyl]-6-ethoxychromen-2-one Traditional Name: 4-[[4-(4-bromobenzoyl)piperazino]methyl]-6-ethoxy-coumarin Formula: C23H23BrN2O4 MolecularWeight: 471.34372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H23BrN2O4/c1-2-29-19-7-8-21-20(14-19)17(13-22(27)30-21)15-25-9-11-26(12-10-25)23(28)16-3-5-18(24)6-4-16/h3-8,13-14H,2,9-12,15H2,1H3