ethyl 2-[2-nitro-4-(propan-2-ylcarbamoyl)phenyl]sulfonylethanoate

Systemtic Name: ethyl 2-[2-nitro-4-(propan-2-ylcarbamoyl)phenyl]sulfonylethanoate Openeye Name: ethyl 2-[4-(isopropylcarbamoyl)-2-nitro-phenyl]sulfonylacetate CAS Name: 2-[2-nitro-4-[oxo-(propan-2-ylamino)methyl]phenyl]sulfonylacetic acid ethyl ester IUPAC Name: ethyl 2-[2-nitro-4-(propan-2-ylcarbamoyl)phenyl]sulfonylacetate Traditional Name: 2-[4-(isopropylcarbamoyl)-2-nitro-phenyl]sulfonylacetic acid ethyl ester Formula: C14H18N2O7S MolecularWeight: 358.36692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)C1=C(C=C(C=C1)C(=O)NC(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CS(=O)(=O)C1=C(C=C(C=C1)C(=O)NC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O7S/c1-4-23-13(17)8-24(21,22)12-6-5-10(7-11(12)16(19)20)14(18)15-9(2)3/h5-7,9H,4,8H2,1-3H3,(H,15,18)