4-nitro-3-oxidanyl-2-(phenylmethyl)-3H-isoindol-1-one

Systemtic Name: 4-nitro-3-oxidanyl-2-(phenylmethyl)-3H-isoindol-1-one Openeye Name: 2-benzyl-3-hydroxy-4-nitro-isoindolin-1-one CAS Name: 3-hydroxy-4-nitro-2-(phenylmethyl)-3H-isoindol-1-one IUPAC Name: 2-benzyl-3-hydroxy-4-nitro-3H-isoindol-1-one Traditional Name: 2-benzyl-3-hydroxy-4-nitro-isoindolin-1-one Formula: C15H12N2O4 MolecularWeight: 284.26678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(C3=C(C2=O)C=CC=C3[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(C3=C(C2=O)C=CC=C3[N+](=O)[O-])O

InChI

InChI=1S/C15H12N2O4/c18-14-11-7-4-8-12(17(20)21)13(11)15(19)16(14)9-10-5-2-1-3-6-10/h1-8,15,19H,9H2