3-bromanyl-4-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-5-methoxy-benzaldehyde

Systemtic Name: 3-bromanyl-4-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-5-methoxy-benzaldehyde Openeye Name: 3-bromo-4-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxo-ethoxy]-5-methoxy-benzaldehyde CAS Name: 3-bromo-4-[2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-oxoethoxy]-5-methoxybenzaldehyde IUPAC Name: 3-bromo-4-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxoethoxy]-5-methoxybenzaldehyde Traditional Name: 3-bromo-4-[2-[4-(4-chlorobenzyl)piperazino]-2-keto-ethoxy]-5-methoxy-benzaldehyde Formula: C21H22BrClN2O4 MolecularWeight: 481.76738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=O)Br)OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)C=O)Br)OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22BrClN2O4/c1-28-19-11-16(13-26)10-18(22)21(19)29-14-20(27)25-8-6-24(7-9-25)12-15-2-4-17(23)5-3-15/h2-5,10-11,13H,6-9,12,14H2,1H3