5-chloranyl-2-[2-[4-[(4-fluorophenyl)methyl]-2-methyl-piperazin-1-yl]-2-oxidanylidene-ethoxy]benzaldehyde

Systemtic Name: 5-chloranyl-2-[2-[4-[(4-fluorophenyl)methyl]-2-methyl-piperazin-1-yl]-2-oxidanylidene-ethoxy]benzaldehyde Openeye Name: 5-chloro-2-[2-[4-[(4-fluorophenyl)methyl]-2-methyl-piperazin-1-yl]-2-oxo-ethoxy]benzaldehyde CAS Name: 5-chloro-2-[2-[4-[(4-fluorophenyl)methyl]-2-methyl-1-piperazinyl]-2-oxoethoxy]benzaldehyde IUPAC Name: 5-chloro-2-[2-[4-[(4-fluorophenyl)methyl]-2-methylpiperazin-1-yl]-2-oxoethoxy]benzaldehyde Traditional Name: 5-chloro-2-[2-[4-(4-fluorobenzyl)-2-methyl-piperazino]-2-keto-ethoxy]benzaldehyde Formula: C21H22ClFN2O3 MolecularWeight: 404.862383

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)COC2=C(C=C(C=C2)Cl)C=O)CC3=CC=C(C=C3)F

Isomeric SMILES

CC1CN(CCN1C(=O)COC2=C(C=C(C=C2)Cl)C=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H22ClFN2O3/c1-15-11-24(12-16-2-5-19(23)6-3-16)8-9-25(15)21(27)14-28-20-7-4-18(22)10-17(20)13-26/h2-7,10,13,15H,8-9,11-12,14H2,1H3