(2R)-4-(5-bromanyl-2-ethoxy-phenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2R)-4-(5-bromanyl-2-ethoxy-phenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2R)-4-(5-bromo-2-ethoxy-phenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2R)-4-(5-bromo-2-ethoxyphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2R)-4-(5-bromo-2-ethoxyphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2R)-4-(5-bromo-2-ethoxy-phenyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C17H17BrN2O5S MolecularWeight: 441.29628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CC(OC3=CC=CC=C32)C(=O)N

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2C[C@@H](OC3=CC=CC=C32)C(=O)N

InChI

InChI=1S/C17H17BrN2O5S/c1-2-24-14-8-7-11(18)9-16(14)26(22,23)20-10-15(17(19)21)25-13-6-4-3-5-12(13)20/h3-9,15H,2,10H2,1H3,(H2,19,21)/t15-/m1/s1