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

Systemtic Name: methyl 4-[3-[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]-2-oxidanyl-propoxy]benzoate Openeye Name: methyl 4-[2-hydroxy-3-[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]propoxy]benzoate CAS Name: 4-[2-hydroxy-3-[4-(2-methyl-1-oxo-2-phenylpropyl)-1-piperazinyl]propoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-hydroxy-3-[4-(2-methyl-2-phenylpropanoyl)piperazin-1-yl]propoxy]benzoate Traditional Name: 4-[2-hydroxy-3-[4-(2-methyl-2-phenyl-propanoyl)piperazino]propoxy]benzoic acid methyl ester Formula: C25H32N2O5 MolecularWeight: 440.53198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N2O5/c1-25(2,20-7-5-4-6-8-20)24(30)27-15-13-26(14-16-27)17-21(28)18-32-22-11-9-19(10-12-22)23(29)31-3/h4-12,21,28H,13-18H2,1-3H3