2-(2-oxidanyl-1-phenyl-ethyl)isoindole-1,3-dione

Systemtic Name: 2-(2-oxidanyl-1-phenyl-ethyl)isoindole-1,3-dione Openeye Name: 2-(2-hydroxy-1-phenyl-ethyl)isoindoline-1,3-dione CAS Name: 2-(2-hydroxy-1-phenylethyl)isoindole-1,3-dione IUPAC Name: 2-(2-hydroxy-1-phenylethyl)isoindole-1,3-dione Traditional Name: 2-(2-hydroxy-1-phenyl-ethyl)isoindoline-1,3-quinone Formula: C16H13NO3 MolecularWeight: 267.27932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CO)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)C(CO)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H13NO3/c18-10-14(11-6-2-1-3-7-11)17-15(19)12-8-4-5-9-13(12)16(17)20/h1-9,14,18H,10H2