2-[2-[4-(methoxycarbonylamino)phenyl]sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethanoic acid

Systemtic Name: 2-[2-[4-(methoxycarbonylamino)phenyl]sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethanoic acid Openeye Name: 2-[2-[4-(methoxycarbonylamino)phenyl]sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid CAS Name: 2-[2-[4-(methoxycarbonylamino)phenyl]sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid IUPAC Name: 2-[2-[4-(methoxycarbonylamino)phenyl]sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid Traditional Name: 2-[2-[4-(carbomethoxyamino)phenyl]sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2CC(=O)O

Isomeric SMILES

COC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2CC(=O)O

InChI

InChI=1S/C19H20N2O6S/c1-27-19(24)20-14-6-8-15(9-7-14)28(25,26)21-11-10-13-4-2-3-5-16(13)17(21)12-18(22)23/h2-9,17H,10-12H2,1H3,(H,20,24)(H,22,23)