ethyl 3-methyl-4-[[4-(phenylsulfonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-methyl-4-[[4-(phenylsulfonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[4-(benzenesulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]-3-methyl-benzoate CAS Name: 4-[[[4-(benzenesulfonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-oxomethyl]amino]-3-methylbenzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(benzenesulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carbonyl]amino]-3-methylbenzoate Traditional Name: 4-[(4-besyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl)amino]-3-methyl-benzoic acid ethyl ester Formula: C25H24N2O6S MolecularWeight: 480.53286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C25H24N2O6S/c1-3-32-25(29)18-13-14-20(17(2)15-18)26-24(28)23-16-27(21-11-7-8-12-22(21)33-23)34(30,31)19-9-5-4-6-10-19/h4-15,23H,3,16H2,1-2H3,(H,26,28)