ethyl (2S)-2-[[(2S)-1-chloranyl-1-oxidanylidene-propan-2-yl]amino]-4-phenyl-butanoate hydrochloride

Systemtic Name: ethyl (2S)-2-[[(2S)-1-chloranyl-1-oxidanylidene-propan-2-yl]amino]-4-phenyl-butanoate hydrochloride Openeye Name: ethyl (2S)-2-[[(1S)-2-chloro-1-methyl-2-oxo-ethyl]amino]-4-phenyl-butanoate hydrochloride CAS Name: (2S)-2-[[(2S)-1-chloro-1-oxopropan-2-yl]amino]-4-phenylbutanoic acid ethyl ester hydrochloride IUPAC Name: ethyl (2S)-2-[[(2S)-1-chloro-1-oxopropan-2-yl]amino]-4-phenylbutanoate hydrochloride Traditional Name: (2S)-2-[[(1S)-2-chloro-2-keto-1-methyl-ethyl]amino]-4-phenyl-butyric acid ethyl ester hydrochloride Formula: C15H21Cl2NO3 MolecularWeight: 334.23814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)Cl.Cl

Isomeric SMILES

CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)Cl.Cl

InChI

InChI=1S/C15H20ClNO3.ClH/c1-3-20-15(19)13(17-11(2)14(16)18)10-9-12-7-5-4-6-8-12;/h4-8,11,13,17H,3,9-10H2,1-2H3;1H/t11-,13-;/m0./s1