methyl (2R)-3-(1H-indol-3-yl)-2-[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]propanoate

Systemtic Name: methyl (2R)-3-(1H-indol-3-yl)-2-[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]propanoate Openeye Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[4-(1-piperidylsulfonyl)benzoyl]amino]propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[oxo-[4-(1-piperidinylsulfonyl)phenyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(1H-indol-3-yl)-2-[(4-piperidin-1-ylsulfonylbenzoyl)amino]propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[(4-piperidinosulfonylbenzoyl)amino]propionic acid methyl ester Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C24H27N3O5S/c1-32-24(29)22(15-18-16-25-21-8-4-3-7-20(18)21)26-23(28)17-9-11-19(12-10-17)33(30,31)27-13-5-2-6-14-27/h3-4,7-12,16,22,25H,2,5-6,13-15H2,1H3,(H,26,28)/t22-/m1/s1