(2S)-3-methyl-2-[(2S)-6-nitro-2H-chromen-2-yl]-5-phenyl-2,3-dihydro-1,3-oxazol-3-ium

Systemtic Name: (2S)-3-methyl-2-[(2S)-6-nitro-2H-chromen-2-yl]-5-phenyl-2,3-dihydro-1,3-oxazol-3-ium Openeye Name: (2S)-3-methyl-2-[(2S)-6-nitro-2H-chromen-2-yl]-5-phenyl-2,3-dihydrooxazol-3-ium CAS Name: (2S)-3-methyl-2-[(2S)-6-nitro-2H-1-benzopyran-2-yl]-5-phenyl-2,3-dihydrooxazol-3-ium IUPAC Name: (2S)-3-methyl-2-[(2S)-6-nitro-2H-chromen-2-yl]-5-phenyl-2,3-dihydro-1,3-oxazol-3-ium Traditional Name: (2S)-3-methyl-2-[(2S)-6-nitro-2H-chromen-2-yl]-5-phenyl-4-oxazolin-3-ium Formula: C19H17N2O4+ MolecularWeight: 337.34928

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1C=C(OC1C2C=CC3=C(O2)C=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C[NH+]1C=C(O[C@H]1[C@@H]2C=CC3=C(O2)C=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C19H16N2O4/c1-20-12-18(13-5-3-2-4-6-13)25-19(20)17-9-7-14-11-15(21(22)23)8-10-16(14)24-17/h2-12,17,19H,1H3/p+1/t17-,19-/m0/s1