ethyl 2-[4-[methyl-(phenylmethyl)carbamoyl]-2-nitro-phenyl]sulfonylethanoate

Systemtic Name: ethyl 2-[4-[methyl-(phenylmethyl)carbamoyl]-2-nitro-phenyl]sulfonylethanoate Openeye Name: ethyl 2-[4-[benzyl(methyl)carbamoyl]-2-nitro-phenyl]sulfonylacetate CAS Name: 2-[4-[[methyl-(phenylmethyl)amino]-oxomethyl]-2-nitrophenyl]sulfonylacetic acid ethyl ester IUPAC Name: ethyl 2-[4-[benzyl(methyl)carbamoyl]-2-nitrophenyl]sulfonylacetate Traditional Name: 2-[4-[benzyl(methyl)carbamoyl]-2-nitro-phenyl]sulfonylacetic acid ethyl ester Formula: C19H20N2O7S MolecularWeight: 420.4363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)C1=C(C=C(C=C1)C(=O)N(C)CC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CS(=O)(=O)C1=C(C=C(C=C1)C(=O)N(C)CC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O7S/c1-3-28-18(22)13-29(26,27)17-10-9-15(11-16(17)21(24)25)19(23)20(2)12-14-7-5-4-6-8-14/h4-11H,3,12-13H2,1-2H3