3-methyl-2-[[3-(5-oxidanyl-1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoic acid

Systemtic Name: 3-methyl-2-[[3-(5-oxidanyl-1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoic acid Openeye Name: 2-[[2-(benzyloxycarbonylamino)-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[3-(5-hydroxy-1H-indol-3-yl)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[3-(5-hydroxy-1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(benzyloxycarbonylamino)-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]-3-methyl-butyric acid Formula: C24H27N3O6 MolecularWeight: 453.48768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27N3O6/c1-14(2)21(23(30)31)27-22(29)20(26-24(32)33-13-15-6-4-3-5-7-15)10-16-12-25-19-9-8-17(28)11-18(16)19/h3-9,11-12,14,20-21,25,28H,10,13H2,1-2H3,(H,26,32)(H,27,29)(H,30,31)