methyl 4-[(1-methylsulfonyl-2,3-dihydroindol-5-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(1-methylsulfonyl-2,3-dihydroindol-5-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(1-methylsulfonylindoline-5-carbonyl)amino]benzoate CAS Name: 4-[[(1-methylsulfonyl-2,3-dihydroindol-5-yl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(1-methylsulfonyl-2,3-dihydroindole-5-carbonyl)amino]benzoate Traditional Name: 4-[(1-mesylindoline-5-carbonyl)amino]benzoic acid methyl ester Formula: C18H18N2O5S MolecularWeight: 374.41092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N(CC3)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N(CC3)S(=O)(=O)C

InChI

InChI=1S/C18H18N2O5S/c1-25-18(22)12-3-6-15(7-4-12)19-17(21)14-5-8-16-13(11-14)9-10-20(16)26(2,23)24/h3-8,11H,9-10H2,1-2H3,(H,19,21)