methyl 4-[[[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonyl-methyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[(3-indolin-1-ylsulfonylbenzoyl)-methyl-amino]methyl]benzoate CAS Name: 4-[[[[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-oxomethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[3-(2,3-dihydroindol-1-ylsulfonyl)benzoyl]-methylamino]methyl]benzoate Traditional Name: 4-[[(3-indolin-1-ylsulfonylbenzoyl)-methyl-amino]methyl]benzoic acid methyl ester Formula: C25H24N2O5S MolecularWeight: 464.53346

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C25H24N2O5S/c1-26(17-18-10-12-20(13-11-18)25(29)32-2)24(28)21-7-5-8-22(16-21)33(30,31)27-15-14-19-6-3-4-9-23(19)27/h3-13,16H,14-15,17H2,1-2H3