(E)-3-[2-(3-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-N-oxidanyl-prop-2-enamide

Systemtic Name: (E)-3-[2-(3-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-N-oxidanyl-prop-2-enamide Openeye Name: (E)-3-[2-(3-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]prop-2-enehydroxamic acid CAS Name: (E)-N-hydroxy-3-[2-(3-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-2-propenamide IUPAC Name: (E)-N-hydroxy-3-[2-(3-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]prop-2-enamide Traditional Name: (E)-3-[2-(3-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]prop-2-enehydroxamic acid Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)C=CC(=O)NO

Isomeric SMILES

COC1=CC(=CC=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)/C=C/C(=O)NO

InChI

InChI=1S/C19H20N2O5S/c1-26-17-3-2-4-18(12-17)27(24,25)21-10-9-15-7-5-14(11-16(15)13-21)6-8-19(22)20-23/h2-8,11-12,23H,9-10,13H2,1H3,(H,20,22)/b8-6+