methyl 4-[2-(3-methoxypropylamino)-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-(3-methoxypropylamino)-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-(3-methoxypropylamino)-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-(3-methoxypropylamino)-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-(3-methoxypropylamino)-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-keto-2-(3-methoxypropylamino)ethoxy]-3-nitro-benzoic acid methyl ester Formula: C14H18N2O7 MolecularWeight: 326.30192

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)COC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COCCCNC(=O)COC1=C(C=C(C=C1)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O7/c1-21-7-3-6-15-13(17)9-23-12-5-4-10(14(18)22-2)8-11(12)16(19)20/h4-5,8H,3,6-7,9H2,1-2H3,(H,15,17)