(3-nitrophenyl) 3-(3,5-dimethoxyphenyl)propanoate

Systemtic Name: (3-nitrophenyl) 3-(3,5-dimethoxyphenyl)propanoate Openeye Name: (3-nitrophenyl) 3-(3,5-dimethoxyphenyl)propanoate CAS Name: 3-(3,5-dimethoxyphenyl)propanoic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 3-(3,5-dimethoxyphenyl)propanoate Traditional Name: 3-(3,5-dimethoxyphenyl)propionic acid (3-nitrophenyl) ester Formula: C17H17NO6 MolecularWeight: 331.31998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC(=O)OC2=CC=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC(=O)OC2=CC=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C17H17NO6/c1-22-15-8-12(9-16(11-15)23-2)6-7-17(19)24-14-5-3-4-13(10-14)18(20)21/h3-5,8-11H,6-7H2,1-2H3