[3-(phenylmethoxymethyl)-1-(phenylmethyl)-2-prop-2-enyl-piperidin-2-yl]methyl benzoate

Systemtic Name: [3-(phenylmethoxymethyl)-1-(phenylmethyl)-2-prop-2-enyl-piperidin-2-yl]methyl benzoate Openeye Name: [2-allyl-1-benzyl-3-(benzyloxymethyl)-2-piperidyl]methyl benzoate CAS Name: benzoic acid [3-(phenylmethoxymethyl)-1-(phenylmethyl)-2-prop-2-enyl-2-piperidinyl]methyl ester IUPAC Name: [1-benzyl-3-(phenylmethoxymethyl)-2-prop-2-enylpiperidin-2-yl]methyl benzoate Traditional Name: benzoic acid [2-allyl-3-(benzoxymethyl)-1-benzyl-2-piperidyl]methyl ester Formula: C31H35NO3 MolecularWeight: 469.6145

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1(C(CCCN1CC2=CC=CC=C2)COCC3=CC=CC=C3)COC(=O)C4=CC=CC=C4

Isomeric SMILES

C=CCC1(C(CCCN1CC2=CC=CC=C2)COCC3=CC=CC=C3)COC(=O)C4=CC=CC=C4

InChI

InChI=1S/C31H35NO3/c1-2-20-31(25-35-30(33)28-17-10-5-11-18-28)29(24-34-23-27-15-8-4-9-16-27)19-12-21-32(31)22-26-13-6-3-7-14-26/h2-11,13-18,29H,1,12,19-25H2