methyl (2R)-2-[3-[(4-ethoxyphenyl)sulfonylamino]propanoylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2R)-2-[3-[(4-ethoxyphenyl)sulfonylamino]propanoylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2R)-2-[3-[(4-ethoxyphenyl)sulfonylamino]propanoylamino]-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-[[3-[(4-ethoxyphenyl)sulfonylamino]-1-oxopropyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[3-[(4-ethoxyphenyl)sulfonylamino]propanoylamino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[3-(p-phenetylsulfonylamino)propanoylamino]propionic acid methyl ester Formula: C23H27N3O6S MolecularWeight: 473.54198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)N[C@H](CC2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C23H27N3O6S/c1-3-32-17-8-10-18(11-9-17)33(29,30)25-13-12-22(27)26-21(23(28)31-2)14-16-15-24-20-7-5-4-6-19(16)20/h4-11,15,21,24-25H,3,12-14H2,1-2H3,(H,26,27)/t21-/m1/s1