tert-butyl N-[(2S)-4-chloranyl-3-oxidanylidene-1-pyridin-4-yl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-4-chloranyl-3-oxidanylidene-1-pyridin-4-yl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-3-chloro-2-oxo-1-(4-pyridylmethyl)propyl]carbamate CAS Name: N-[(2S)-4-chloro-3-oxo-1-pyridin-4-ylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-4-chloro-3-oxo-1-pyridin-4-ylbutan-2-yl]carbamate Traditional Name: N-[(1S)-3-chloro-2-keto-1-(4-pyridylmethyl)propyl]carbamic acid tert-butyl ester Formula: C14H19ClN2O3 MolecularWeight: 298.76526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=NC=C1)C(=O)CCl

InChI

InChI=1S/C14H19ClN2O3/c1-14(2,3)20-13(19)17-11(12(18)9-15)8-10-4-6-16-7-5-10/h4-7,11H,8-9H2,1-3H3,(H,17,19)/t11-/m0/s1