methyl 3-(1H-indol-3-yl)-2-[(1-methylsulfonyl-2,3-dihydroindol-5-yl)carbonylamino]propanoate

Systemtic Name: methyl 3-(1H-indol-3-yl)-2-[(1-methylsulfonyl-2,3-dihydroindol-5-yl)carbonylamino]propanoate Openeye Name: methyl 3-(1H-indol-3-yl)-2-[(1-methylsulfonylindoline-5-carbonyl)amino]propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[(1-methylsulfonyl-2,3-dihydroindol-5-yl)-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(1H-indol-3-yl)-2-[(1-methylsulfonyl-2,3-dihydroindole-5-carbonyl)amino]propanoate Traditional Name: 3-(1H-indol-3-yl)-2-[(1-mesylindoline-5-carbonyl)amino]propionic acid methyl ester Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC4=C(C=C3)N(CC4)S(=O)(=O)C

Isomeric SMILES

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC4=C(C=C3)N(CC4)S(=O)(=O)C

InChI

InChI=1S/C22H23N3O5S/c1-30-22(27)19(12-16-13-23-18-6-4-3-5-17(16)18)24-21(26)15-7-8-20-14(11-15)9-10-25(20)31(2,28)29/h3-8,11,13,19,23H,9-10,12H2,1-2H3,(H,24,26)