4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)butanoic acid

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)butanoic acid Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)butanoic acid CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)butanoic acid IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)butanoic acid Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)butyric acid Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)NCCCC(=O)O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)NCCCC(=O)O

InChI

InChI=1S/C13H18N2O4S/c16-13(17)6-3-8-14-20(18,19)15-9-7-11-4-1-2-5-12(11)10-15/h1-2,4-5,14H,3,6-10H2,(H,16,17)