[(1S)-1-(2-methoxyphenyl)ethyl]-methyl-[(4-nitrophenyl)methyl]azanium

Systemtic Name: [(1S)-1-(2-methoxyphenyl)ethyl]-methyl-[(4-nitrophenyl)methyl]azanium Openeye Name: [(1S)-1-(2-methoxyphenyl)ethyl]-methyl-[(4-nitrophenyl)methyl]ammonium CAS Name: [(1S)-1-(2-methoxyphenyl)ethyl]-methyl-[(4-nitrophenyl)methyl]ammonium IUPAC Name: [(1S)-1-(2-methoxyphenyl)ethyl]-methyl-[(4-nitrophenyl)methyl]azanium Traditional Name: [(1S)-1-(2-methoxyphenyl)ethyl]-methyl-(4-nitrobenzyl)ammonium Formula: C17H21N2O3+ MolecularWeight: 301.36024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1OC)[NH+](C)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1OC)[NH+](C)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O3/c1-13(16-6-4-5-7-17(16)22-3)18(2)12-14-8-10-15(11-9-14)19(20)21/h4-11,13H,12H2,1-3H3/p+1/t13-/m0/s1