ethyl 2-[[4-(azepan-1-ylsulfonyl)phenyl]sulfonylamino]ethanoate

Systemtic Name: ethyl 2-[[4-(azepan-1-ylsulfonyl)phenyl]sulfonylamino]ethanoate Openeye Name: ethyl 2-[[4-(azepan-1-ylsulfonyl)phenyl]sulfonylamino]acetate CAS Name: 2-[[4-(1-azepanylsulfonyl)phenyl]sulfonylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-(azepan-1-ylsulfonyl)phenyl]sulfonylamino]acetate Traditional Name: 2-[[4-(azepan-1-ylsulfonyl)phenyl]sulfonylamino]acetic acid ethyl ester Formula: C16H24N2O6S2 MolecularWeight: 404.50156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CCOC(=O)CNS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C16H24N2O6S2/c1-2-24-16(19)13-17-25(20,21)14-7-9-15(10-8-14)26(22,23)18-11-5-3-4-6-12-18/h7-10,17H,2-6,11-13H2,1H3