4-[4-[3-(4-bromanyl-2-methyl-phenoxy)propanoyl]piperazin-1-yl]benzaldehyde

Systemtic Name: 4-[4-[3-(4-bromanyl-2-methyl-phenoxy)propanoyl]piperazin-1-yl]benzaldehyde Openeye Name: 4-[4-[3-(4-bromo-2-methyl-phenoxy)propanoyl]piperazin-1-yl]benzaldehyde CAS Name: 4-[4-[3-(4-bromo-2-methylphenoxy)-1-oxopropyl]-1-piperazinyl]benzaldehyde IUPAC Name: 4-[4-[3-(4-bromo-2-methylphenoxy)propanoyl]piperazin-1-yl]benzaldehyde Traditional Name: 4-[4-[3-(4-bromo-2-methyl-phenoxy)propanoyl]piperazino]benzaldehyde Formula: C21H23BrN2O3 MolecularWeight: 431.32292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)C=O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)C=O

InChI

InChI=1S/C21H23BrN2O3/c1-16-14-18(22)4-7-20(16)27-13-8-21(26)24-11-9-23(10-12-24)19-5-2-17(15-25)3-6-19/h2-7,14-15H,8-13H2,1H3