diethyl 2-[[3-(5-oxidanyl-1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanedioate

Systemtic Name: diethyl 2-[[3-(5-oxidanyl-1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanedioate Openeye Name: diethyl 2-[[2-(benzyloxycarbonylamino)-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]pentanedioate CAS Name: 2-[[3-(5-hydroxy-1H-indol-3-yl)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl 2-[[3-(5-hydroxy-1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanedioate Traditional Name: 2-[[2-(benzyloxycarbonylamino)-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]glutaric acid diethyl ester Formula: C28H33N3O8 MolecularWeight: 539.57692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C(CC1=CNC2=C1C=C(C=C2)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCC(C(=O)OCC)NC(=O)C(CC1=CNC2=C1C=C(C=C2)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H33N3O8/c1-3-37-25(33)13-12-23(27(35)38-4-2)30-26(34)24(31-28(36)39-17-18-8-6-5-7-9-18)14-19-16-29-22-11-10-20(32)15-21(19)22/h5-11,15-16,23-24,29,32H,3-4,12-14,17H2,1-2H3,(H,30,34)(H,31,36)