piperazin-1-yl 2-[1-(4-hexoxyphenyl)piperidin-4-yl]benzoate

Systemtic Name: piperazin-1-yl 2-[1-(4-hexoxyphenyl)piperidin-4-yl]benzoate Openeye Name: piperazin-1-yl 2-[1-(4-hexoxyphenyl)-4-piperidyl]benzoate CAS Name: 2-[1-(4-hexoxyphenyl)-4-piperidinyl]benzoic acid 1-piperazinyl ester IUPAC Name: piperazin-1-yl 2-[1-(4-hexoxyphenyl)piperidin-4-yl]benzoate Traditional Name: 2-[1-(4-hexoxyphenyl)-4-piperidyl]benzoic acid piperazino ester Formula: C28H39N3O3 MolecularWeight: 465.62756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)N2CCC(CC2)C3=CC=CC=C3C(=O)ON4CCNCC4

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)N2CCC(CC2)C3=CC=CC=C3C(=O)ON4CCNCC4

InChI

InChI=1S/C28H39N3O3/c1-2-3-4-7-22-33-25-12-10-24(11-13-25)30-18-14-23(15-19-30)26-8-5-6-9-27(26)28(32)34-31-20-16-29-17-21-31/h5-6,8-13,23,29H,2-4,7,14-22H2,1H3