4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-nitro-benzamide

Systemtic Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-nitro-benzamide Openeye Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-nitro-benzamide CAS Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-nitrobenzamide IUPAC Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-nitrobenzamide Traditional Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-nitro-benzamide Formula: C16H15N3O5 MolecularWeight: 329.3074

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-])OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-])OC1

InChI

InChI=1S/C16H15N3O5/c17-16(20)10-2-4-12(13(8-10)19(21)22)18-11-3-5-14-15(9-11)24-7-1-6-23-14/h2-5,8-9,18H,1,6-7H2,(H2,17,20)