methyl 4-[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-[methyl(2-thienylmethyl)amino]-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-keto-2-[methyl(2-thenyl)amino]ethoxy]-3-nitro-benzoic acid methyl ester Formula: C16H16N2O6S MolecularWeight: 364.37304

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CS1)C(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=CS1)C(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O6S/c1-17(9-12-4-3-7-25-12)15(19)10-24-14-6-5-11(16(20)23-2)8-13(14)18(21)22/h3-8H,9-10H2,1-2H3