(4-chlorophenyl)methyl-[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]azanium

Systemtic Name: (4-chlorophenyl)methyl-[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]azanium Openeye Name: (4-chlorophenyl)methyl-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]ammonium CAS Name: (4-chlorophenyl)methyl-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]ammonium IUPAC Name: (4-chlorophenyl)methyl-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]azanium Traditional Name: (4-chlorobenzyl)-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]ammonium Formula: C15H16ClN2O3+ MolecularWeight: 307.75214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C[NH2+]CC(C2=CC=C(C=C2)[N+](=O)[O-])O)Cl

Isomeric SMILES

C1=CC(=CC=C1C[NH2+]C[C@H](C2=CC=C(C=C2)[N+](=O)[O-])O)Cl

InChI

InChI=1S/C15H15ClN2O3/c16-13-5-1-11(2-6-13)9-17-10-15(19)12-3-7-14(8-4-12)18(20)21/h1-8,15,17,19H,9-10H2/p+1/t15-/m1/s1