ethyl 4-[4-(4-hexoxyphenyl)piperidin-1-yl]benzoate

Systemtic Name: ethyl 4-[4-(4-hexoxyphenyl)piperidin-1-yl]benzoate Openeye Name: ethyl 4-[4-(4-hexoxyphenyl)-1-piperidyl]benzoate CAS Name: 4-[4-(4-hexoxyphenyl)-1-piperidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-hexoxyphenyl)piperidin-1-yl]benzoate Traditional Name: 4-[4-(4-hexoxyphenyl)piperidino]benzoic acid ethyl ester Formula: C26H35NO3 MolecularWeight: 409.561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2CCN(CC2)C3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2CCN(CC2)C3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C26H35NO3/c1-3-5-6-7-20-30-25-14-10-21(11-15-25)22-16-18-27(19-17-22)24-12-8-23(9-13-24)26(28)29-4-2/h8-15,22H,3-7,16-20H2,1-2H3