2-[[2-[[2-(3-methoxy-3-oxidanylidene-propyl)phenyl]methyl]phenyl]carbonylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[[2-[[2-(3-methoxy-3-oxidanylidene-propyl)phenyl]methyl]phenyl]carbonylamino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[[2-[[2-(3-methoxy-3-oxo-propyl)phenyl]methyl]benzoyl]amino]propanoic acid CAS Name: 3-hydroxy-2-[[[2-[[2-(3-methoxy-3-oxopropyl)phenyl]methyl]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[[2-[[2-(3-methoxy-3-oxopropyl)phenyl]methyl]benzoyl]amino]propanoic acid Traditional Name: 3-hydroxy-2-[[2-[2-(3-keto-3-methoxy-propyl)benzyl]benzoyl]amino]propionic acid Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=CC=C1CC2=CC=CC=C2C(=O)NC(CO)C(=O)O

Isomeric SMILES

COC(=O)CCC1=CC=CC=C1CC2=CC=CC=C2C(=O)NC(CO)C(=O)O

InChI

InChI=1S/C21H23NO6/c1-28-19(24)11-10-14-6-2-3-7-15(14)12-16-8-4-5-9-17(16)20(25)22-18(13-23)21(26)27/h2-9,18,23H,10-13H2,1H3,(H,22,25)(H,26,27)