N-[4-[(2S)-butan-2-yl]phenyl]-3-oxidanylidene-4H-1,4-benzoxazine-6-sulfonamide

Systemtic Name: N-[4-[(2S)-butan-2-yl]phenyl]-3-oxidanylidene-4H-1,4-benzoxazine-6-sulfonamide Openeye Name: N-[4-[(1S)-1-methylpropyl]phenyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide CAS Name: N-[4-[(2S)-butan-2-yl]phenyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide IUPAC Name: N-[4-[(2S)-butan-2-yl]phenyl]-3-oxo-4H-1,4-benzoxazine-6-sulfonamide Traditional Name: 3-keto-N-[4-[(1S)-1-methylpropyl]phenyl]-4H-1,4-benzoxazine-6-sulfonamide Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3

InChI

InChI=1S/C18H20N2O4S/c1-3-12(2)13-4-6-14(7-5-13)20-25(22,23)15-8-9-17-16(10-15)19-18(21)11-24-17/h4-10,12,20H,3,11H2,1-2H3,(H,19,21)/t12-/m0/s1