(3-nitrophenyl)methyl 4-butoxybenzoate

Systemtic Name: (3-nitrophenyl)methyl 4-butoxybenzoate Openeye Name: (3-nitrophenyl)methyl 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid (3-nitrobenzyl) ester Formula: C18H19NO5 MolecularWeight: 329.34716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19NO5/c1-2-3-11-23-17-9-7-15(8-10-17)18(20)24-13-14-5-4-6-16(12-14)19(21)22/h4-10,12H,2-3,11,13H2,1H3