6-nitro-N-(4-phenylazanylphenyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: 6-nitro-N-(4-phenylazanylphenyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-(4-anilinophenyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-(4-anilinophenyl)-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-(4-anilinophenyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-(4-anilinophenyl)-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C21H17N3O5 MolecularWeight: 391.37678

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)NC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)NC4=CC=CC=C4

InChI

InChI=1S/C21H17N3O5/c25-21(17-12-19-20(29-11-10-28-19)13-18(17)24(26)27)23-16-8-6-15(7-9-16)22-14-4-2-1-3-5-14/h1-9,12-13,22H,10-11H2,(H,23,25)