(3R)-2-propanoyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: (3R)-2-propanoyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: (3R)-2-propanoyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: (3R)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: (3R)-2-propanoyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: (3R)-2-propionyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CC2=CC=CC=C2CC1C(=O)O

Isomeric SMILES

CCC(=O)N1CC2=CC=CC=C2C[C@@H]1C(=O)O

InChI

InChI=1S/C13H15NO3/c1-2-12(15)14-8-10-6-4-3-5-9(10)7-11(14)13(16)17/h3-6,11H,2,7-8H2,1H3,(H,16,17)/t11-/m1/s1