methyl 4-[3-(4-naphthalen-1-ylcarbonylpiperazin-1-yl)-2-oxidanyl-propoxy]benzoate

Systemtic Name: methyl 4-[3-(4-naphthalen-1-ylcarbonylpiperazin-1-yl)-2-oxidanyl-propoxy]benzoate Openeye Name: methyl 4-[2-hydroxy-3-[4-(naphthalene-1-carbonyl)piperazin-1-yl]propoxy]benzoate CAS Name: 4-[2-hydroxy-3-[4-[1-naphthalenyl(oxo)methyl]-1-piperazinyl]propoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-hydroxy-3-[4-(naphthalene-1-carbonyl)piperazin-1-yl]propoxy]benzoate Traditional Name: 4-[2-hydroxy-3-[4-(1-naphthoyl)piperazino]propoxy]benzoic acid methyl ester Formula: C26H28N2O5 MolecularWeight: 448.51092

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C(=O)C3=CC=CC4=CC=CC=C43)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C(=O)C3=CC=CC4=CC=CC=C43)O

InChI

InChI=1S/C26H28N2O5/c1-32-26(31)20-9-11-22(12-10-20)33-18-21(29)17-27-13-15-28(16-14-27)25(30)24-8-4-6-19-5-2-3-7-23(19)24/h2-12,21,29H,13-18H2,1H3