3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propanoate

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propanoate Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propanoate CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propanoate IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propanoate Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)propionate Formula: C12H14NO4S- MolecularWeight: 268.30886

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)CCC(=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)CCC(=O)[O-]

InChI

InChI=1S/C12H15NO4S/c14-12(15)6-8-18(16,17)13-7-5-10-3-1-2-4-11(10)9-13/h1-4H,5-9H2,(H,14,15)/p-1