(4-aminocarbonyl-2-nitro-phenyl)methyl 4-propoxybenzoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 4-propoxybenzoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O6/c1-2-9-25-15-7-5-12(6-8-15)18(22)26-11-14-4-3-13(17(19)21)10-16(14)20(23)24/h3-8,10H,2,9,11H2,1H3,(H2,19,21)