2-[[3-(1H-indol-3-yl)-2-(phenylmethoxyamino)propanoyl]amino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[[3-(1H-indol-3-yl)-2-(phenylmethoxyamino)propanoyl]amino]-3-oxidanyl-propanoic acid Openeye Name: 2-[[2-(benzyloxyamino)-3-(1H-indol-3-yl)propanoyl]amino]-3-hydroxy-propanoic acid CAS Name: 3-hydroxy-2-[[3-(1H-indol-3-yl)-1-oxo-2-(phenylmethoxyamino)propyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[[3-(1H-indol-3-yl)-2-(phenylmethoxyamino)propanoyl]amino]propanoic acid Traditional Name: 2-[[2-(benzoxyamino)-3-(1H-indol-3-yl)propanoyl]amino]-3-hydroxy-propionic acid Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CONC(CC2=CNC3=CC=CC=C32)C(=O)NC(CO)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CONC(CC2=CNC3=CC=CC=C32)C(=O)NC(CO)C(=O)O

InChI

InChI=1S/C21H23N3O5/c25-12-19(21(27)28)23-20(26)18(24-29-13-14-6-2-1-3-7-14)10-15-11-22-17-9-5-4-8-16(15)17/h1-9,11,18-19,22,24-25H,10,12-13H2,(H,23,26)(H,27,28)