(2S)-3-(4-methylphenyl)-2-(4-nitrophenyl)propanoate

Systemtic Name: (2S)-3-(4-methylphenyl)-2-(4-nitrophenyl)propanoate Openeye Name: (2S)-2-(4-nitrophenyl)-3-(p-tolyl)propanoate CAS Name: (2S)-3-(4-methylphenyl)-2-(4-nitrophenyl)propanoate IUPAC Name: (2S)-3-(4-methylphenyl)-2-(4-nitrophenyl)propanoate Traditional Name: (2S)-2-(4-nitrophenyl)-3-(p-tolyl)propionate Formula: C16H14NO4- MolecularWeight: 284.28666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C[C@@H](C2=CC=C(C=C2)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C16H15NO4/c1-11-2-4-12(5-3-11)10-15(16(18)19)13-6-8-14(9-7-13)17(20)21/h2-9,15H,10H2,1H3,(H,18,19)/p-1/t15-/m0/s1