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

Systemtic Name: methyl 2-(phenylmethoxymethyl)-4-(phenylmethyl)-5-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate Openeye Name: methyl 4-benzyl-2-(benzyloxymethyl)-5-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate CAS Name: 2-(phenylmethoxymethyl)-4-(phenylmethyl)-5-(1-pyrrolidinylmethyl)-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-benzyl-2-(phenylmethoxymethyl)-5-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate Traditional Name: 2-(benzoxymethyl)-4-benzyl-5-(pyrrolidinomethyl)piperazine-1-carboxylic acid methyl ester Formula: C26H35N3O3 MolecularWeight: 437.5744

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CC(N(CC1COCC2=CC=CC=C2)CC3=CC=CC=C3)CN4CCCC4

Isomeric SMILES

COC(=O)N1CC(N(CC1COCC2=CC=CC=C2)CC3=CC=CC=C3)CN4CCCC4

InChI

InChI=1S/C26H35N3O3/c1-31-26(30)29-19-24(17-27-14-8-9-15-27)28(16-22-10-4-2-5-11-22)18-25(29)21-32-20-23-12-6-3-7-13-23/h2-7,10-13,24-25H,8-9,14-21H2,1H3