4-[[(6-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)amino]methyl]-3-nitro-benzamide

Systemtic Name: 4-[[(6-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)amino]methyl]-3-nitro-benzamide Openeye Name: 4-[[(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)amino]methyl]-3-nitro-benzamide CAS Name: 4-[[(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)amino]methyl]-3-nitrobenzamide IUPAC Name: 4-[[(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)amino]methyl]-3-nitrobenzamide Traditional Name: 4-[[(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)amino]methyl]-3-nitro-benzamide Formula: C16H14ClN3O5 MolecularWeight: 363.75246

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Cl)NCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Cl)NCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN3O5/c17-11-6-14-15(25-4-3-24-14)7-12(11)19-8-10-2-1-9(16(18)21)5-13(10)20(22)23/h1-2,5-7,19H,3-4,8H2,(H2,18,21)