3-nitro-1-[(2,4,6-trimethylphenyl)iminomethyl]-6,7,8,9-tetrahydrodibenzofuran-2-olate

Systemtic Name: 3-nitro-1-[(2,4,6-trimethylphenyl)iminomethyl]-6,7,8,9-tetrahydrodibenzofuran-2-olate Openeye Name: 3-nitro-1-[(2,4,6-trimethylphenyl)iminomethyl]-6,7,8,9-tetrahydrodibenzofuran-2-olate CAS Name: 3-nitro-1-[(2,4,6-trimethylphenyl)iminomethyl]-6,7,8,9-tetrahydrodibenzofuran-2-olate IUPAC Name: 3-nitro-1-[(2,4,6-trimethylphenyl)iminomethyl]-6,7,8,9-tetrahydrodibenzofuran-2-olate Traditional Name: 1-(mesityliminomethyl)-3-nitro-6,7,8,9-tetrahydrodibenzofuran-2-olate Formula: C22H21N2O4- MolecularWeight: 377.41314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N=CC2=C(C(=CC3=C2C4=C(O3)CCCC4)[N+](=O)[O-])[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N=CC2=C(C(=CC3=C2C4=C(O3)CCCC4)[N+](=O)[O-])[O-])C

InChI

InChI=1S/C22H22N2O4/c1-12-8-13(2)21(14(3)9-12)23-11-16-20-15-6-4-5-7-18(15)28-19(20)10-17(22(16)25)24(26)27/h8-11,25H,4-7H2,1-3H3/p-1