(2-methoxy-2-oxidanylidene-ethyl) (2S)-2-[(4-ethoxyphenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl) (2S)-2-[(4-ethoxyphenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: (2-methoxy-2-oxo-ethyl) (2S)-2-[(4-ethoxyphenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-[(4-ethoxyphenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoic acid (2-methoxy-2-oxoethyl) ester IUPAC Name: (2-methoxy-2-oxoethyl) (2S)-2-[(4-ethoxyphenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-3-(1H-indol-3-yl)-2-(p-phenetylsulfonylamino)propionic acid (2-keto-2-methoxy-ethyl) ester Formula: C22H24N2O7S MolecularWeight: 460.50016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O7S/c1-3-30-16-8-10-17(11-9-16)32(27,28)24-20(22(26)31-14-21(25)29-2)12-15-13-23-19-7-5-4-6-18(15)19/h4-11,13,20,23-24H,3,12,14H2,1-2H3/t20-/m0/s1