[3-[[1-adamantyl(ethanoyl)amino]methyl]-1-(phenylmethyl)piperidin-4-yl] ethanoate

Systemtic Name: [3-[[1-adamantyl(ethanoyl)amino]methyl]-1-(phenylmethyl)piperidin-4-yl] ethanoate Openeye Name: [3-[[acetyl(1-adamantyl)amino]methyl]-1-benzyl-4-piperidyl] acetate CAS Name: acetic acid [3-[[acetyl(1-adamantyl)amino]methyl]-1-(phenylmethyl)-4-piperidinyl] ester IUPAC Name: [3-[[acetyl(1-adamantyl)amino]methyl]-1-benzylpiperidin-4-yl] acetate Traditional Name: acetic acid [3-[[acetyl(1-adamantyl)amino]methyl]-1-benzyl-4-piperidyl] ester Formula: C27H38N2O3 MolecularWeight: 438.60222

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC1CN(CCC1OC(=O)C)CC2=CC=CC=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(=O)N(CC1CN(CCC1OC(=O)C)CC2=CC=CC=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H38N2O3/c1-19(30)29(27-13-22-10-23(14-27)12-24(11-22)15-27)18-25-17-28(9-8-26(25)32-20(2)31)16-21-6-4-3-5-7-21/h3-7,22-26H,8-18H2,1-2H3