(2S)-2-azanyl-3-cyclohexa-2,5-dien-1-yl-propanoic acid

Systemtic Name: (2S)-2-azanyl-3-cyclohexa-2,5-dien-1-yl-propanoic acid Openeye Name: (2S)-2-amino-3-cyclohexa-2,5-dien-1-yl-propanoic acid CAS Name: (2S)-2-amino-3-(1-cyclohexa-2,5-dienyl)propanoic acid IUPAC Name: (2S)-2-amino-3-cyclohexa-2,5-dien-1-ylpropanoic acid Traditional Name: (2S)-2-amino-3-cyclohexa-2,5-dien-1-yl-propionic acid Formula: C9H13NO2 MolecularWeight: 167.20502

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(C=C1)CC(C(=O)O)N

Isomeric SMILES

C1C=CC(C=C1)C[C@@H](C(=O)O)N

InChI

InChI=1S/C9H13NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h2-5,7-8H,1,6,10H2,(H,11,12)/t8-/m0/s1