2-[(3R)-4-(4-methoxyphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-3-yl]ethanoate

Systemtic Name: 2-[(3R)-4-(4-methoxyphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-3-yl]ethanoate Openeye Name: 2-[(3R)-4-(4-methoxyphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-3-yl]acetate CAS Name: 2-[(3R)-4-(4-methoxyphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-3-yl]acetate IUPAC Name: 2-[(3R)-4-(4-methoxyphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-3-yl]acetate Traditional Name: 2-[(3R)-4-(4-methoxyphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazin-3-yl]acetate Formula: C17H16NO6S- MolecularWeight: 362.37704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2C(COC3=CC=CC=C32)CC(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2[C@@H](COC3=CC=CC=C32)CC(=O)[O-]

InChI

InChI=1S/C17H17NO6S/c1-23-13-6-8-14(9-7-13)25(21,22)18-12(10-17(19)20)11-24-16-5-3-2-4-15(16)18/h2-9,12H,10-11H2,1H3,(H,19,20)/p-1/t12-/m1/s1