methyl-[(2S)-2-(3-nitrophenyl)-2-oxidanyl-ethyl]-phenethyl-azanium

Systemtic Name: methyl-[(2S)-2-(3-nitrophenyl)-2-oxidanyl-ethyl]-phenethyl-azanium Openeye Name: [(2S)-2-hydroxy-2-(3-nitrophenyl)ethyl]-methyl-phenethyl-ammonium CAS Name: [(2S)-2-hydroxy-2-(3-nitrophenyl)ethyl]-methyl-phenethylammonium IUPAC Name: [(2S)-2-hydroxy-2-(3-nitrophenyl)ethyl]-methyl-phenethylazanium Traditional Name: [(2S)-2-hydroxy-2-(3-nitrophenyl)ethyl]-methyl-phenethyl-ammonium Formula: C17H21N2O3+ MolecularWeight: 301.36024

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)CC(C2=CC(=CC=C2)[N+](=O)[O-])O

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)C[C@H](C2=CC(=CC=C2)[N+](=O)[O-])O

InChI

InChI=1S/C17H20N2O3/c1-18(11-10-14-6-3-2-4-7-14)13-17(20)15-8-5-9-16(12-15)19(21)22/h2-9,12,17,20H,10-11,13H2,1H3/p+1/t17-/m1/s1