3-ethoxypropyl-[(4-methoxy-3-nitro-phenyl)methyl]azanium

Systemtic Name: 3-ethoxypropyl-[(4-methoxy-3-nitro-phenyl)methyl]azanium Openeye Name: 3-ethoxypropyl-[(4-methoxy-3-nitro-phenyl)methyl]ammonium CAS Name: 3-ethoxypropyl-[(4-methoxy-3-nitrophenyl)methyl]ammonium IUPAC Name: 3-ethoxypropyl-[(4-methoxy-3-nitrophenyl)methyl]azanium Traditional Name: 3-ethoxypropyl-(4-methoxy-3-nitro-benzyl)ammonium Formula: C13H21N2O4+ MolecularWeight: 269.31684

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC[NH2+]CC1=CC(=C(C=C1)OC)[N+](=O)[O-]

Isomeric SMILES

CCOCCC[NH2+]CC1=CC(=C(C=C1)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H20N2O4/c1-3-19-8-4-7-14-10-11-5-6-13(18-2)12(9-11)15(16)17/h5-6,9,14H,3-4,7-8,10H2,1-2H3/p+1