N-[(2-chloranyl-5-nitro-phenyl)methyl]-1,3-benzodioxol-5-amine

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-1,3-benzodioxol-5-amine Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-1,3-benzodioxol-5-amine CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-1,3-benzodioxol-5-amine IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-1,3-benzodioxol-5-amine Traditional Name: 1,3-benzodioxol-5-yl-(2-chloro-5-nitro-benzyl)amine Formula: C14H11ClN2O4 MolecularWeight: 306.70114

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NCC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NCC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H11ClN2O4/c15-12-3-2-11(17(18)19)5-9(12)7-16-10-1-4-13-14(6-10)21-8-20-13/h1-6,16H,7-8H2