N-(3,5-dimethylphenyl)-4-(furan-2-ylcarbonyl)-2,3-dihydro-1,4-benzoxazine-7-sulfonamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-(furan-2-ylcarbonyl)-2,3-dihydro-1,4-benzoxazine-7-sulfonamide Openeye Name: N-(3,5-dimethylphenyl)-4-(furan-2-carbonyl)-2,3-dihydro-1,4-benzoxazine-7-sulfonamide CAS Name: N-(3,5-dimethylphenyl)-4-[2-furanyl(oxo)methyl]-2,3-dihydro-1,4-benzoxazine-7-sulfonamide IUPAC Name: N-(3,5-dimethylphenyl)-4-(furan-2-carbonyl)-2,3-dihydro-1,4-benzoxazine-7-sulfonamide Traditional Name: N-(3,5-dimethylphenyl)-4-(2-furoyl)-2,3-dihydro-1,4-benzoxazine-7-sulfonamide Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(CCO3)C(=O)C4=CC=CO4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(CCO3)C(=O)C4=CC=CO4)C

InChI

InChI=1S/C21H20N2O5S/c1-14-10-15(2)12-16(11-14)22-29(25,26)17-5-6-18-20(13-17)28-9-7-23(18)21(24)19-4-3-8-27-19/h3-6,8,10-13,22H,7,9H2,1-2H3