N-(1,3-benzodioxol-5-ylmethyl)-2-chloranyl-4-nitro-aniline

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloranyl-4-nitro-aniline Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-4-nitro-aniline CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-4-nitroaniline IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-4-nitroaniline Traditional Name: (2-chloro-4-nitro-phenyl)-piperonyl-amine Formula: C14H11ClN2O4 MolecularWeight: 306.70114

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

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