2-[[(2S)-butan-2-yl]-[(4-chlorophenyl)methyl]amino]ethanoic acid

Systemtic Name: 2-[[(2S)-butan-2-yl]-[(4-chlorophenyl)methyl]amino]ethanoic acid Openeye Name: 2-[(4-chlorophenyl)methyl-[(1S)-1-methylpropyl]amino]acetic acid CAS Name: 2-[[(2S)-butan-2-yl]-[(4-chlorophenyl)methyl]amino]acetic acid IUPAC Name: 2-[[(2S)-butan-2-yl]-[(4-chlorophenyl)methyl]amino]acetic acid Traditional Name: 2-[(4-chlorobenzyl)-[(1S)-1-methylpropyl]amino]acetic acid Formula: C13H18ClNO2 MolecularWeight: 255.74052

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=C(C=C1)Cl)CC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C13H18ClNO2/c1-3-10(2)15(9-13(16)17)8-11-4-6-12(14)7-5-11/h4-7,10H,3,8-9H2,1-2H3,(H,16,17)/t10-/m0/s1