dimethyl-[2-[3-(3-methyl-4-nitro-phenoxy)propylazaniumyl]ethyl]azanium

Systemtic Name: dimethyl-[2-[3-(3-methyl-4-nitro-phenoxy)propylazaniumyl]ethyl]azanium Openeye Name: dimethyl-[2-[3-(3-methyl-4-nitro-phenoxy)propylammonio]ethyl]ammonium CAS Name: dimethyl-[2-[3-(3-methyl-4-nitrophenoxy)propylammonio]ethyl]ammonium IUPAC Name: dimethyl-[2-[3-(3-methyl-4-nitrophenoxy)propylazaniumyl]ethyl]azanium Traditional Name: dimethyl-[2-[3-(3-methyl-4-nitro-phenoxy)propylammonio]ethyl]ammonium Formula: C14H25N3O3+2 MolecularWeight: 283.3666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCC[NH2+]CC[NH+](C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCCC[NH2+]CC[NH+](C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H23N3O3/c1-12-11-13(5-6-14(12)17(18)19)20-10-4-7-15-8-9-16(2)3/h5-6,11,15H,4,7-10H2,1-3H3/p+2