tert-butyl N-[(2S,3E)-1-phenyl-3-pyrrolidin-1-ylimino-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3E)-1-phenyl-3-pyrrolidin-1-ylimino-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2E)-1-benzyl-2-pyrrolidin-1-ylimino-ethyl]carbamate CAS Name: N-[(2S,3E)-1-phenyl-3-(1-pyrrolidinylimino)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3E)-1-phenyl-3-pyrrolidin-1-yliminopropan-2-yl]carbamate Traditional Name: N-[(1S,2E)-1-benzyl-2-pyrrolidinoimino-ethyl]carbamic acid tert-butyl ester Formula: C18H27N3O2 MolecularWeight: 317.42588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C=NN2CCCC2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)/C=N/N2CCCC2

InChI

InChI=1S/C18H27N3O2/c1-18(2,3)23-17(22)20-16(13-15-9-5-4-6-10-15)14-19-21-11-7-8-12-21/h4-6,9-10,14,16H,7-8,11-13H2,1-3H3,(H,20,22)/b19-14+/t16-/m0/s1