[(R)-1,3-benzodioxol-5-yl-(2-methyl-5-nitro-phenyl)methyl]azanium

Systemtic Name: [(R)-1,3-benzodioxol-5-yl-(2-methyl-5-nitro-phenyl)methyl]azanium Openeye Name: [(R)-1,3-benzodioxol-5-yl-(2-methyl-5-nitro-phenyl)methyl]ammonium CAS Name: [(R)-1,3-benzodioxol-5-yl-(2-methyl-5-nitrophenyl)methyl]ammonium IUPAC Name: [(R)-1,3-benzodioxol-5-yl-(2-methyl-5-nitrophenyl)methyl]azanium Traditional Name: [(R)-1,3-benzodioxol-5-yl-(2-methyl-5-nitro-phenyl)methyl]ammonium Formula: C15H15N2O4+ MolecularWeight: 287.2906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])C(C2=CC3=C(C=C2)OCO3)[NH3+]

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])[C@@H](C2=CC3=C(C=C2)OCO3)[NH3+]

InChI

InChI=1S/C15H14N2O4/c1-9-2-4-11(17(18)19)7-12(9)15(16)10-3-5-13-14(6-10)21-8-20-13/h2-7,15H,8,16H2,1H3/p+1/t15-/m1/s1