methyl 5-(hydroxymethyl)-2-(phenylmethoxymethyl)-4-(phenylmethyl)piperazine-1-carboxylate

Systemtic Name: methyl 5-(hydroxymethyl)-2-(phenylmethoxymethyl)-4-(phenylmethyl)piperazine-1-carboxylate Openeye Name: methyl 4-benzyl-2-(benzyloxymethyl)-5-(hydroxymethyl)piperazine-1-carboxylate CAS Name: 5-(hydroxymethyl)-2-(phenylmethoxymethyl)-4-(phenylmethyl)-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-benzyl-5-(hydroxymethyl)-2-(phenylmethoxymethyl)piperazine-1-carboxylate Traditional Name: 2-(benzoxymethyl)-4-benzyl-5-methylol-piperazine-1-carboxylic acid methyl ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CC(N(CC1COCC2=CC=CC=C2)CC3=CC=CC=C3)CO

Isomeric SMILES

COC(=O)N1CC(N(CC1COCC2=CC=CC=C2)CC3=CC=CC=C3)CO

InChI

InChI=1S/C22H28N2O4/c1-27-22(26)24-14-20(15-25)23(12-18-8-4-2-5-9-18)13-21(24)17-28-16-19-10-6-3-7-11-19/h2-11,20-21,25H,12-17H2,1H3