5-[(1S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]furan-2-carboxylate

Systemtic Name: 5-[(1S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]furan-2-carboxylate Openeye Name: 5-[(1S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]furan-2-carboxylate CAS Name: 5-[(1S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-furancarboxylate IUPAC Name: 5-[(1S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]furan-2-carboxylate Traditional Name: 5-[(1S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-furoate Formula: C16H16NO3- MolecularWeight: 270.30314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(O1)C(=O)[O-])N2CCC3=CC=CC=C3C2

Isomeric SMILES

C[C@@H](C1=CC=C(O1)C(=O)[O-])N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C16H17NO3/c1-11(14-6-7-15(20-14)16(18)19)17-9-8-12-4-2-3-5-13(12)10-17/h2-7,11H,8-10H2,1H3,(H,18,19)/p-1/t11-/m0/s1