methyl 3-[(6-chloranyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)carbonylamino]-2-methyl-benzoate

Systemtic Name: methyl 3-[(6-chloranyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)carbonylamino]-2-methyl-benzoate Openeye Name: methyl 3-[(6-chloro-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl)amino]-2-methyl-benzoate CAS Name: 3-[[(6-chloro-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)-oxomethyl]amino]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(6-chloro-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl)amino]-2-methylbenzoate Traditional Name: 3-[(6-chloro-4-mesyl-2,3-dihydro-1,4-benzoxazine-2-carbonyl)amino]-2-methyl-benzoic acid methyl ester Formula: C19H19ClN2O6S MolecularWeight: 438.88196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2CN(C3=C(O2)C=CC(=C3)Cl)S(=O)(=O)C)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2CN(C3=C(O2)C=CC(=C3)Cl)S(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C19H19ClN2O6S/c1-11-13(19(24)27-2)5-4-6-14(11)21-18(23)17-10-22(29(3,25)26)15-9-12(20)7-8-16(15)28-17/h4-9,17H,10H2,1-3H3,(H,21,23)