N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-nitro-4-phenylazanyl-benzamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-nitro-4-phenylazanyl-benzamide Openeye Name: 4-anilino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-nitro-benzamide CAS Name: 4-anilino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-nitrobenzamide IUPAC Name: 4-anilino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-nitrobenzamide Traditional Name: 4-anilino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-nitro-benzamide Formula: C21H17N3O5 MolecularWeight: 391.37678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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