methyl 3-[[5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxy-phenyl]carbonylamino]-4-fluoranyl-benzoate

Systemtic Name: methyl 3-[[5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxy-phenyl]carbonylamino]-4-fluoranyl-benzoate Openeye Name: methyl 4-fluoro-3-[(5-indolin-1-ylsulfonyl-2-methoxy-benzoyl)amino]benzoate CAS Name: 3-[[[5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxyphenyl]-oxomethyl]amino]-4-fluorobenzoic acid methyl ester IUPAC Name: methyl 3-[[5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxybenzoyl]amino]-4-fluorobenzoate Traditional Name: 4-fluoro-3-[(5-indolin-1-ylsulfonyl-2-methoxy-benzoyl)amino]benzoic acid methyl ester Formula: C24H21FN2O6S MolecularWeight: 484.496743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32)C(=O)NC4=C(C=CC(=C4)C(=O)OC)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32)C(=O)NC4=C(C=CC(=C4)C(=O)OC)F

InChI

InChI=1S/C24H21FN2O6S/c1-32-22-10-8-17(34(30,31)27-12-11-15-5-3-4-6-21(15)27)14-18(22)23(28)26-20-13-16(24(29)33-2)7-9-19(20)25/h3-10,13-14H,11-12H2,1-2H3,(H,26,28)