methyl 7-[4-[(4-methylphenyl)-phenyl-methoxy]piperidin-1-yl]heptanoate

Systemtic Name: methyl 7-[4-[(4-methylphenyl)-phenyl-methoxy]piperidin-1-yl]heptanoate Openeye Name: methyl 7-[4-[phenyl(p-tolyl)methoxy]-1-piperidyl]heptanoate CAS Name: 7-[4-[(4-methylphenyl)-phenylmethoxy]-1-piperidinyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[4-[(4-methylphenyl)-phenylmethoxy]piperidin-1-yl]heptanoate Traditional Name: 7-[4-[phenyl(p-tolyl)methoxy]piperidino]enanthic acid methyl ester Formula: C27H37NO3 MolecularWeight: 423.58758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)OC3CCN(CC3)CCCCCCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CC=C2)OC3CCN(CC3)CCCCCCC(=O)OC

InChI

InChI=1S/C27H37NO3/c1-22-13-15-24(16-14-22)27(23-10-6-5-7-11-23)31-25-17-20-28(21-18-25)19-9-4-3-8-12-26(29)30-2/h5-7,10-11,13-16,25,27H,3-4,8-9,12,17-21H2,1-2H3