tert-butyl N-[(2S)-4-chloranyl-3-oxidanylidene-1-quinolin-6-yl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-4-chloranyl-3-oxidanylidene-1-quinolin-6-yl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-3-chloro-2-oxo-1-(6-quinolylmethyl)propyl]carbamate CAS Name: N-[(2S)-4-chloro-3-oxo-1-(6-quinolinyl)butan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-4-chloro-3-oxo-1-quinolin-6-ylbutan-2-yl]carbamate Traditional Name: N-[(1S)-3-chloro-2-keto-1-(6-quinolylmethyl)propyl]carbamic acid tert-butyl ester Formula: C18H21ClN2O3 MolecularWeight: 348.82394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC2=C(C=C1)N=CC=C2)C(=O)CCl

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC2=C(C=C1)N=CC=C2)C(=O)CCl

InChI

InChI=1S/C18H21ClN2O3/c1-18(2,3)24-17(23)21-15(16(22)11-19)10-12-6-7-14-13(9-12)5-4-8-20-14/h4-9,15H,10-11H2,1-3H3,(H,21,23)/t15-/m0/s1