3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]propanamide

Systemtic Name: 3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]propanamide Openeye Name: 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]propanamide CAS Name: 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]propanamide IUPAC Name: 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]propanamide Traditional Name: 3-(3-keto-2-methyl-1,4-benzoxazin-4-yl)-N-[2-(4-mesyl-2-nitro-anilino)ethyl]propionamide Formula: C21H24N4O7S MolecularWeight: 476.50286

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NCCNC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NCCNC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O7S/c1-14-21(27)24(17-5-3-4-6-19(17)32-14)12-9-20(26)23-11-10-22-16-8-7-15(33(2,30)31)13-18(16)25(28)29/h3-8,13-14,22H,9-12H2,1-2H3,(H,23,26)