4-[3-[4-(2-chlorophenyl)piperazin-1-yl]-2-oxidanyl-propoxy]-3-methoxy-benzaldehyde

Systemtic Name: 4-[3-[4-(2-chlorophenyl)piperazin-1-yl]-2-oxidanyl-propoxy]-3-methoxy-benzaldehyde Openeye Name: 4-[3-[4-(2-chlorophenyl)piperazin-1-yl]-2-hydroxy-propoxy]-3-methoxy-benzaldehyde CAS Name: 4-[3-[4-(2-chlorophenyl)-1-piperazinyl]-2-hydroxypropoxy]-3-methoxybenzaldehyde IUPAC Name: 4-[3-[4-(2-chlorophenyl)piperazin-1-yl]-2-hydroxypropoxy]-3-methoxybenzaldehyde Traditional Name: 4-[3-[4-(2-chlorophenyl)piperazino]-2-hydroxy-propoxy]-3-methoxy-benzaldehyde Formula: C21H25ClN2O4 MolecularWeight: 404.8872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=O)OCC(CN2CCN(CC2)C3=CC=CC=C3Cl)O

Isomeric SMILES

COC1=C(C=CC(=C1)C=O)OCC(CN2CCN(CC2)C3=CC=CC=C3Cl)O

InChI

InChI=1S/C21H25ClN2O4/c1-27-21-12-16(14-25)6-7-20(21)28-15-17(26)13-23-8-10-24(11-9-23)19-5-3-2-4-18(19)22/h2-7,12,14,17,26H,8-11,13,15H2,1H3