4-nitro-2-(1-phenylethyl)isoindole-1,3-dione

Systemtic Name: 4-nitro-2-(1-phenylethyl)isoindole-1,3-dione Openeye Name: 4-nitro-2-(1-phenylethyl)isoindoline-1,3-dione CAS Name: 4-nitro-2-(1-phenylethyl)isoindole-1,3-dione IUPAC Name: 4-nitro-2-(1-phenylethyl)isoindole-1,3-dione Traditional Name: 4-nitro-2-(1-phenylethyl)isoindoline-1,3-quinone Formula: C16H12N2O4 MolecularWeight: 296.27748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O4/c1-10(11-6-3-2-4-7-11)17-15(19)12-8-5-9-13(18(21)22)14(12)16(17)20/h2-10H,1H3