(3R)-2-prop-2-enoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: (3R)-2-prop-2-enoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: (3R)-2-prop-2-enoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-(1-oxoprop-2-enyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate IUPAC Name: (3R)-2-prop-2-enoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-acryloyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Formula: C13H12NO3- MolecularWeight: 230.23928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)N1CC2=CC=CC=C2CC1C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO3/c1-2-12(15)14-8-10-6-4-3-5-9(10)7-11(14)13(16)17/h2-6,11H,1,7-8H2,(H,16,17)/p-1/t11-/m1/s1