methyl 5-azanyl-2-butoxy-4-nitro-benzoate

Systemtic Name: methyl 5-azanyl-2-butoxy-4-nitro-benzoate Openeye Name: methyl 5-amino-2-butoxy-4-nitro-benzoate CAS Name: 5-amino-2-butoxy-4-nitrobenzoic acid methyl ester IUPAC Name: methyl 5-amino-2-butoxy-4-nitrobenzoate Traditional Name: 5-amino-2-butoxy-4-nitro-benzoic acid methyl ester Formula: C12H16N2O5 MolecularWeight: 268.26584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1C(=O)OC)N)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC(=C(C=C1C(=O)OC)N)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O5/c1-3-4-5-19-11-7-10(14(16)17)9(13)6-8(11)12(15)18-2/h6-7H,3-5,13H2,1-2H3