methyl (5R)-1,4-bis(phenylmethyl)-1,4-diazepane-5-carboxylate

Systemtic Name: methyl (5R)-1,4-bis(phenylmethyl)-1,4-diazepane-5-carboxylate Openeye Name: methyl (5R)-1,4-dibenzyl-1,4-diazepane-5-carboxylate CAS Name: (5R)-1,4-bis(phenylmethyl)-1,4-diazepane-5-carboxylic acid methyl ester IUPAC Name: methyl (5R)-1,4-dibenzyl-1,4-diazepane-5-carboxylate Traditional Name: (5R)-1,4-dibenzyl-1,4-diazepane-5-carboxylic acid methyl ester Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CCN1CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@H]1CCN(CCN1CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O2/c1-25-21(24)20-12-13-22(16-18-8-4-2-5-9-18)14-15-23(20)17-19-10-6-3-7-11-19/h2-11,20H,12-17H2,1H3/t20-/m1/s1