2-[[4-(3-bromophenyl)carbonylpiperazin-1-yl]methyl]-1H-quinolin-4-one

Systemtic Name: 2-[[4-(3-bromophenyl)carbonylpiperazin-1-yl]methyl]-1H-quinolin-4-one Openeye Name: 2-[[4-(3-bromobenzoyl)piperazin-1-yl]methyl]-1H-quinolin-4-one CAS Name: 2-[[4-[(3-bromophenyl)-oxomethyl]-1-piperazinyl]methyl]-1H-quinolin-4-one IUPAC Name: 2-[[4-(3-bromobenzoyl)piperazin-1-yl]methyl]-1H-quinolin-4-one Traditional Name: 2-[[4-(3-bromobenzoyl)piperazino]methyl]-4-quinolone Formula: C21H20BrN3O2 MolecularWeight: 426.3064

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=O)C3=CC=CC=C3N2)C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=CC(=O)C3=CC=CC=C3N2)C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C21H20BrN3O2/c22-16-5-3-4-15(12-16)21(27)25-10-8-24(9-11-25)14-17-13-20(26)18-6-1-2-7-19(18)23-17/h1-7,12-13H,8-11,14H2,(H,23,26)