N-(4-chloranyl-2-nitro-phenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-amine

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Openeye Name: N-(4-chloro-2-nitro-phenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-amine CAS Name: N-(4-chloro-2-nitrophenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-amine IUPAC Name: N-(4-chloro-2-nitrophenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Traditional Name: (4-chloro-2-nitro-phenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)amine Formula: C15H13ClN2O4 MolecularWeight: 320.72772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13ClN2O4/c16-10-2-4-12(13(8-10)18(19)20)17-11-3-5-14-15(9-11)22-7-1-6-21-14/h2-5,8-9,17H,1,6-7H2