tert-butyl (2R,4R)-2-[(4-cyclopropyl-1,4-diazepan-1-yl)carbonyl]-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2R,4R)-2-[(4-cyclopropyl-1,4-diazepan-1-yl)carbonyl]-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2R,4R)-2-(4-cyclopropyl-1,4-diazepane-1-carbonyl)-4-hydroxy-pyrrolidine-1-carboxylate CAS Name: (2R,4R)-2-[(4-cyclopropyl-1,4-diazepan-1-yl)-oxomethyl]-4-hydroxy-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,4R)-2-(4-cyclopropyl-1,4-diazepane-1-carbonyl)-4-hydroxypyrrolidine-1-carboxylate Traditional Name: (2R,4R)-2-(4-cyclopropyl-1,4-diazepane-1-carbonyl)-4-hydroxy-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C18H31N3O4 MolecularWeight: 353.45644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCCN(CC2)C3CC3)O

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H](C[C@@H]1C(=O)N2CCCN(CC2)C3CC3)O

InChI

InChI=1S/C18H31N3O4/c1-18(2,3)25-17(24)21-12-14(22)11-15(21)16(23)20-8-4-7-19(9-10-20)13-5-6-13/h13-15,22H,4-12H2,1-3H3/t14-,15-/m1/s1