ethyl 2-[4-[(3-methylsulfonylphenyl)sulfonylamino]-4,5,6,7-tetrahydroindazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[(3-methylsulfonylphenyl)sulfonylamino]-4,5,6,7-tetrahydroindazol-1-yl]ethanoate Openeye Name: ethyl 2-[4-[(3-methylsulfonylphenyl)sulfonylamino]-4,5,6,7-tetrahydroindazol-1-yl]acetate CAS Name: 2-[4-[(3-methylsulfonylphenyl)sulfonylamino]-4,5,6,7-tetrahydroindazol-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(3-methylsulfonylphenyl)sulfonylamino]-4,5,6,7-tetrahydroindazol-1-yl]acetate Traditional Name: 2-[4-[(3-mesylphenyl)sulfonylamino]-4,5,6,7-tetrahydroindazol-1-yl]acetic acid ethyl ester Formula: C18H23N3O6S2 MolecularWeight: 441.52172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=N1)C(CCC2)NS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)CN1C2=C(C=N1)C(CCC2)NS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)C

InChI

InChI=1S/C18H23N3O6S2/c1-3-27-18(22)12-21-17-9-5-8-16(15(17)11-19-21)20-29(25,26)14-7-4-6-13(10-14)28(2,23)24/h4,6-7,10-11,16,20H,3,5,8-9,12H2,1-2H3