N-[4-(3-methylphenoxy)phenyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-[4-(3-methylphenoxy)phenyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-[4-(3-methylphenoxy)phenyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-[4-(3-methylphenoxy)phenyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-[4-(3-methylphenoxy)phenyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-[4-(3-methylphenoxy)phenyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C22H18N2O6 MolecularWeight: 406.38812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCCO4

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCCO4

InChI

InChI=1S/C22H18N2O6/c1-14-3-2-4-17(11-14)30-16-7-5-15(6-8-16)23-22(25)18-12-20-21(29-10-9-28-20)13-19(18)24(26)27/h2-8,11-13H,9-10H2,1H3,(H,23,25)