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

Systemtic Name: 3-[3-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]benzaldehyde Openeye Name: 3-[2-hydroxy-3-[4-(3-methoxyphenyl)piperazin-1-yl]propoxy]benzaldehyde CAS Name: 3-[2-hydroxy-3-[4-(3-methoxyphenyl)-1-piperazinyl]propoxy]benzaldehyde IUPAC Name: 3-[2-hydroxy-3-[4-(3-methoxyphenyl)piperazin-1-yl]propoxy]benzaldehyde Traditional Name: 3-[2-hydroxy-3-[4-(3-methoxyphenyl)piperazino]propoxy]benzaldehyde Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)CC(COC3=CC=CC(=C3)C=O)O

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)CC(COC3=CC=CC(=C3)C=O)O

InChI

InChI=1S/C21H26N2O4/c1-26-20-6-3-5-18(13-20)23-10-8-22(9-11-23)14-19(25)16-27-21-7-2-4-17(12-21)15-24/h2-7,12-13,15,19,25H,8-11,14,16H2,1H3