(4,5-dimethoxy-2-nitro-phenyl)methyl-ethyl-(phenylmethyl)azanium

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)methyl-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-ethyl-ammonium CAS Name: (4,5-dimethoxy-2-nitrophenyl)methyl-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(4,5-dimethoxy-2-nitrophenyl)methyl]-ethylazanium Traditional Name: benzyl-(4,5-dimethoxy-2-nitro-benzyl)-ethyl-ammonium Formula: C18H23N2O4+ MolecularWeight: 331.38622

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C18H22N2O4/c1-4-19(12-14-8-6-5-7-9-14)13-15-10-17(23-2)18(24-3)11-16(15)20(21)22/h5-11H,4,12-13H2,1-3H3/p+1