methyl 4-[3-[4-(2-methylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]benzoate

Systemtic Name: methyl 4-[3-[4-(2-methylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]benzoate Openeye Name: methyl 4-[2-hydroxy-3-[4-(o-tolyl)piperazin-1-yl]propoxy]benzoate CAS Name: 4-[2-hydroxy-3-[4-(2-methylphenyl)-1-piperazinyl]propoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-hydroxy-3-[4-(2-methylphenyl)piperazin-1-yl]propoxy]benzoate Traditional Name: 4-[2-hydroxy-3-[4-(o-tolyl)piperazino]propoxy]benzoic acid methyl ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=C(C=C3)C(=O)OC)O

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=C(C=C3)C(=O)OC)O

InChI

InChI=1S/C22H28N2O4/c1-17-5-3-4-6-21(17)24-13-11-23(12-14-24)15-19(25)16-28-20-9-7-18(8-10-20)22(26)27-2/h3-10,19,25H,11-16H2,1-2H3