3-(4-methylphenyl)-2-nitro-1-benzofuran-5-carbaldehyde

Systemtic Name: 3-(4-methylphenyl)-2-nitro-1-benzofuran-5-carbaldehyde Openeye Name: 2-nitro-3-(p-tolyl)benzofuran-5-carbaldehyde CAS Name: 3-(4-methylphenyl)-2-nitro-5-benzofurancarboxaldehyde IUPAC Name: 3-(4-methylphenyl)-2-nitro-1-benzofuran-5-carbaldehyde Traditional Name: 2-nitro-3-(p-tolyl)benzofuran-5-carbaldehyde Formula: C16H11NO4 MolecularWeight: 281.26284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(OC3=C2C=C(C=C3)C=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(OC3=C2C=C(C=C3)C=O)[N+](=O)[O-]

InChI

InChI=1S/C16H11NO4/c1-10-2-5-12(6-3-10)15-13-8-11(9-18)4-7-14(13)21-16(15)17(19)20/h2-9H,1H3