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(2S)-2-azanyl-3-(2-methyl-6-propan-2-yl-phenyl)propanoic acid

(2S)-2-azanyl-3-(2-methyl-6-propan-2-yl-phenyl)propanoic acid

Systemtic Name:(2S)-2-azanyl-3-(2-methyl-6-propan-2-yl-phenyl)propanoic acid
Openeye Name:(2S)-2-amino-3-(2-isopropyl-6-methyl-phenyl)propanoic acid
CAS Name:(2S)-2-amino-3-(2-methyl-6-propan-2-ylphenyl)propanoic acid
IUPAC Name:(2S)-2-amino-3-(2-methyl-6-propan-2-ylphenyl)propanoic acid
Traditional Name:(2S)-2-amino-3-(2-isopropyl-6-methyl-phenyl)propionic acid
Formula: C13H19NO2
MolecularWeight: 221.29546
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C13H19NO2/c1-8(2)10-6-4-5-9(3)11(10)7-12(14)13(15)16/h4-6,8,12H,7,14H2,1-3H3,(H,15,16)/t12-/m0/s1


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