4-(3-bromanylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]butanamide

Systemtic Name: 4-(3-bromanylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]butanamide Openeye Name: 4-(3-bromophenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]butanamide CAS Name: 4-(3-bromophenoxy)-N-[2-(4-methyl-1-piperazinyl)phenyl]butanamide IUPAC Name: 4-(3-bromophenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]butanamide Traditional Name: 4-(3-bromophenoxy)-N-[2-(4-methylpiperazino)phenyl]butyramide Formula: C21H26BrN3O2 MolecularWeight: 432.35404

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC=C2NC(=O)CCCOC3=CC(=CC=C3)Br

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC=C2NC(=O)CCCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H26BrN3O2/c1-24-11-13-25(14-12-24)20-9-3-2-8-19(20)23-21(26)10-5-15-27-18-7-4-6-17(22)16-18/h2-4,6-9,16H,5,10-15H2,1H3,(H,23,26)