(2R)-2-[[1,3-bis(oxidanylidene)-2-phenethyl-isoindol-5-yl]carbonylamino]-3-oxidanyl-propanoic acid

Systemtic Name: (2R)-2-[[1,3-bis(oxidanylidene)-2-phenethyl-isoindol-5-yl]carbonylamino]-3-oxidanyl-propanoic acid Openeye Name: (2R)-2-[(1,3-dioxo-2-phenethyl-isoindoline-5-carbonyl)amino]-3-hydroxy-propanoic acid CAS Name: (2R)-2-[[(1,3-dioxo-2-phenethyl-5-isoindolyl)-oxomethyl]amino]-3-hydroxypropanoic acid IUPAC Name: (2R)-2-[(1,3-dioxo-2-phenethylisoindole-5-carbonyl)amino]-3-hydroxypropanoic acid Traditional Name: (2R)-2-[(1,3-diketo-2-phenethyl-isoindoline-5-carbonyl)amino]-3-hydroxy-propionic acid Formula: C20H18N2O6 MolecularWeight: 382.36672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC(CO)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N[C@H](CO)C(=O)O

InChI

InChI=1S/C20H18N2O6/c23-11-16(20(27)28)21-17(24)13-6-7-14-15(10-13)19(26)22(18(14)25)9-8-12-4-2-1-3-5-12/h1-7,10,16,23H,8-9,11H2,(H,21,24)(H,27,28)/t16-/m1/s1