2-azanyl-3-(4-oxidanyl-4-propyl-cyclohexa-2,5-dien-1-yl)propanoic acid

Systemtic Name: 2-azanyl-3-(4-oxidanyl-4-propyl-cyclohexa-2,5-dien-1-yl)propanoic acid Openeye Name: 2-amino-3-(4-hydroxy-4-propyl-cyclohexa-2,5-dien-1-yl)propanoic acid CAS Name: 2-amino-3-(4-hydroxy-4-propyl-1-cyclohexa-2,5-dienyl)propanoic acid IUPAC Name: 2-amino-3-(4-hydroxy-4-propylcyclohexa-2,5-dien-1-yl)propanoic acid Traditional Name: 2-amino-3-(4-hydroxy-4-propyl-cyclohexa-2,5-dien-1-yl)propionic acid Formula: C12H19NO3 MolecularWeight: 225.28416

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C=CC(C=C1)CC(C(=O)O)N)O

Isomeric SMILES

CCCC1(C=CC(C=C1)CC(C(=O)O)N)O

InChI

InChI=1S/C12H19NO3/c1-2-5-12(16)6-3-9(4-7-12)8-10(13)11(14)15/h3-4,6-7,9-10,16H,2,5,8,13H2,1H3,(H,14,15)