methyl (2S)-2-(phenylmethoxycarbonylamino)-3-[1-(phenylsulfonyl)indol-4-yl]oxy-propanoate

Systemtic Name: methyl (2S)-2-(phenylmethoxycarbonylamino)-3-[1-(phenylsulfonyl)indol-4-yl]oxy-propanoate Openeye Name: methyl (2S)-3-[1-(benzenesulfonyl)indol-4-yl]oxy-2-(benzyloxycarbonylamino)propanoate CAS Name: (2S)-3-[[1-(benzenesulfonyl)-4-indolyl]oxy]-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl (2S)-3-[1-(benzenesulfonyl)indol-4-yl]oxy-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-(1-besylindol-4-yl)oxy-propionic acid methyl ester Formula: C26H24N2O7S MolecularWeight: 508.54296

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(COC1=CC=CC2=C1C=CN2S(=O)(=O)C3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@H](COC1=CC=CC2=C1C=CN2S(=O)(=O)C3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H24N2O7S/c1-33-25(29)22(27-26(30)35-17-19-9-4-2-5-10-19)18-34-24-14-8-13-23-21(24)15-16-28(23)36(31,32)20-11-6-3-7-12-20/h2-16,22H,17-18H2,1H3,(H,27,30)/t22-/m0/s1