N,N-diethyl-4-[(2R,5S)-5-(4-nitrophenyl)-1,3-oxazolidin-3-ium-2-yl]aniline

Systemtic Name: N,N-diethyl-4-[(2R,5S)-5-(4-nitrophenyl)-1,3-oxazolidin-3-ium-2-yl]aniline Openeye Name: N,N-diethyl-4-[(2R,5S)-5-(4-nitrophenyl)oxazolidin-3-ium-2-yl]aniline CAS Name: N,N-diethyl-4-[(2R,5S)-5-(4-nitrophenyl)-2-oxazolidin-3-iumyl]aniline IUPAC Name: N,N-diethyl-4-[(2R,5S)-5-(4-nitrophenyl)-1,3-oxazolidin-3-ium-2-yl]aniline Traditional Name: diethyl-[4-[(2R,5S)-5-(4-nitrophenyl)oxazolidin-3-ium-2-yl]phenyl]amine Formula: C19H24N3O3+ MolecularWeight: 342.41216

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C2[NH2+]CC(O2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)[C@@H]2[NH2+]C[C@@H](O2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O3/c1-3-21(4-2)16-9-7-15(8-10-16)19-20-13-18(25-19)14-5-11-17(12-6-14)22(23)24/h5-12,18-20H,3-4,13H2,1-2H3/p+1/t18-,19-/m1/s1