tert-butyl (2S)-2-azanyl-3-(3-cyclopentylphenyl)propanoate hydrochloride

Systemtic Name: tert-butyl (2S)-2-azanyl-3-(3-cyclopentylphenyl)propanoate hydrochloride Openeye Name: tert-butyl (2S)-2-amino-3-(3-cyclopentylphenyl)propanoate hydrochloride CAS Name: (2S)-2-amino-3-(3-cyclopentylphenyl)propanoic acid tert-butyl ester hydrochloride IUPAC Name: tert-butyl (2S)-2-amino-3-(3-cyclopentylphenyl)propanoate hydrochloride Traditional Name: (2S)-2-amino-3-(3-cyclopentylphenyl)propionic acid tert-butyl ester hydrochloride Formula: C18H28ClNO2 MolecularWeight: 325.87342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=CC(=C1)C2CCCC2)N.Cl

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC1=CC=CC(=C1)C2CCCC2)N.Cl

InChI

InChI=1S/C18H27NO2.ClH/c1-18(2,3)21-17(20)16(19)12-13-7-6-10-15(11-13)14-8-4-5-9-14;/h6-7,10-11,14,16H,4-5,8-9,12,19H2,1-3H3;1H/t16-;/m0./s1