3-(4-methoxy-3-naphthalen-2-yl-5-nitro-phenyl)propanoic acid

Systemtic Name: 3-(4-methoxy-3-naphthalen-2-yl-5-nitro-phenyl)propanoic acid Openeye Name: 3-[4-methoxy-3-(2-naphthyl)-5-nitro-phenyl]propanoic acid CAS Name: 3-[4-methoxy-3-(2-naphthalenyl)-5-nitrophenyl]propanoic acid IUPAC Name: 3-(4-methoxy-3-naphthalen-2-yl-5-nitrophenyl)propanoic acid Traditional Name: 3-[4-methoxy-3-(2-naphthyl)-5-nitro-phenyl]propionic acid Formula: C20H17NO5 MolecularWeight: 351.35268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C2=CC3=CC=CC=C3C=C2)CCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1C2=CC3=CC=CC=C3C=C2)CCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C20H17NO5/c1-26-20-17(16-8-7-14-4-2-3-5-15(14)12-16)10-13(6-9-19(22)23)11-18(20)21(24)25/h2-5,7-8,10-12H,6,9H2,1H3,(H,22,23)