ethyl 3-[2-[(2,5-dimethylphenyl)sulfonylamino]ethylcarbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[2-[(2,5-dimethylphenyl)sulfonylamino]ethylcarbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[2-[(2,5-dimethylphenyl)sulfonylamino]ethylcarbamoyl]-5-nitro-benzoate CAS Name: 3-[[2-[(2,5-dimethylphenyl)sulfonylamino]ethylamino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[2-[(2,5-dimethylphenyl)sulfonylamino]ethylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[2-[(2,5-dimethylphenyl)sulfonylamino]ethylcarbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C20H23N3O7S MolecularWeight: 449.47752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O7S/c1-4-30-20(25)16-10-15(11-17(12-16)23(26)27)19(24)21-7-8-22-31(28,29)18-9-13(2)5-6-14(18)3/h5-6,9-12,22H,4,7-8H2,1-3H3,(H,21,24)