tert-butyl N-[(2R)-1-[2-phenoxyethanoyl(pyridin-3-ylmethyl)amino]propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2R)-1-[2-phenoxyethanoyl(pyridin-3-ylmethyl)amino]propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-1-methyl-2-[(2-phenoxyacetyl)-(3-pyridylmethyl)amino]ethyl]carbamate CAS Name: N-[(2R)-1-[(1-oxo-2-phenoxyethyl)-(3-pyridinylmethyl)amino]propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-1-[(2-phenoxyacetyl)-(pyridin-3-ylmethyl)amino]propan-2-yl]carbamate Traditional Name: N-[(1R)-1-methyl-2-[(2-phenoxyacetyl)-(3-pyridylmethyl)amino]ethyl]carbamic acid tert-butyl ester Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC1=CN=CC=C1)C(=O)COC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

C[C@H](CN(CC1=CN=CC=C1)C(=O)COC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H29N3O4/c1-17(24-21(27)29-22(2,3)4)14-25(15-18-9-8-12-23-13-18)20(26)16-28-19-10-6-5-7-11-19/h5-13,17H,14-16H2,1-4H3,(H,24,27)/t17-/m1/s1