3-[(8-fluoranyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]-4-methoxy-benzoate

Systemtic Name: 3-[(8-fluoranyl-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]-4-methoxy-benzoate Openeye Name: 3-[(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]-4-methoxy-benzoate CAS Name: 3-[(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]-4-methoxybenzoate IUPAC Name: 3-[(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]-4-methoxybenzoate Traditional Name: 3-[(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)sulfonyl]-4-methoxy-benzoate Formula: C17H15FNO5S- MolecularWeight: 364.368103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)[O-])S(=O)(=O)N2CCCC3=C2C(=CC=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)[O-])S(=O)(=O)N2CCCC3=C2C(=CC=C3)F

InChI

InChI=1S/C17H16FNO5S/c1-24-14-8-7-12(17(20)21)10-15(14)25(22,23)19-9-3-5-11-4-2-6-13(18)16(11)19/h2,4,6-8,10H,3,5,9H2,1H3,(H,20,21)/p-1