1,3-benzodioxol-5-yl 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: 1,3-benzodioxol-5-yl 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: 1,3-benzodioxol-5-yl 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-acetamidophenyl)sulfonyl-methylamino]acetic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 2-[(4-acetamidophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]acetic acid 1,3-benzodioxol-5-yl ester Formula: C18H18N2O7S MolecularWeight: 406.40972

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)OC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)OC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H18N2O7S/c1-12(21)19-13-3-6-15(7-4-13)28(23,24)20(2)10-18(22)27-14-5-8-16-17(9-14)26-11-25-16/h3-9H,10-11H2,1-2H3,(H,19,21)