(2-methanoyl-4-nitro-phenyl) 3-butoxybenzoate

Systemtic Name: (2-methanoyl-4-nitro-phenyl) 3-butoxybenzoate Openeye Name: (2-formyl-4-nitro-phenyl) 3-butoxybenzoate CAS Name: 3-butoxybenzoic acid (2-formyl-4-nitrophenyl) ester IUPAC Name: (2-formyl-4-nitrophenyl) 3-butoxybenzoate Traditional Name: 3-butoxybenzoic acid (2-formyl-4-nitro-phenyl) ester Formula: C18H17NO6 MolecularWeight: 343.33068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])C=O

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])C=O

InChI

InChI=1S/C18H17NO6/c1-2-3-9-24-16-6-4-5-13(11-16)18(21)25-17-8-7-15(19(22)23)10-14(17)12-20/h4-8,10-12H,2-3,9H2,1H3