(4-nitrophenyl) 3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: (4-nitrophenyl) 3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: (4-nitrophenyl) 3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(3,4,5-trimethoxyphenyl)propanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(3,4,5-trimethoxyphenyl)propionic acid (4-nitrophenyl) ester Formula: C18H19NO7 MolecularWeight: 361.34596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19NO7/c1-23-15-10-12(11-16(24-2)18(15)25-3)4-9-17(20)26-14-7-5-13(6-8-14)19(21)22/h5-8,10-11H,4,9H2,1-3H3