N-(6-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-4-(methylamino)-3-nitro-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2Cl)OCCO3)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2Cl)OCCO3)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClN3O5/c1-18-11-3-2-9(6-13(11)20(22)23)16(21)19-12-8-15-14(7-10(12)17)24-4-5-25-15/h2-3,6-8,18H,4-5H2,1H3,(H,19,21)