ethyl 2-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl-(4-methoxyphenyl)sulfonyl-amino]ethanoate

Systemtic Name: ethyl 2-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl-(4-methoxyphenyl)sulfonyl-amino]ethanoate Openeye Name: ethyl 2-[(6-chloro-1,3-benzodioxol-5-yl)methyl-(4-methoxyphenyl)sulfonyl-amino]acetate CAS Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methyl-(4-methoxyphenyl)sulfonylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(6-chloro-1,3-benzodioxol-5-yl)methyl-(4-methoxyphenyl)sulfonylamino]acetate Traditional Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methyl-(4-methoxyphenyl)sulfonyl-amino]acetic acid ethyl ester Formula: C19H20ClNO7S MolecularWeight: 441.8826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC1=CC2=C(C=C1Cl)OCO2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)CN(CC1=CC2=C(C=C1Cl)OCO2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H20ClNO7S/c1-3-26-19(22)11-21(29(23,24)15-6-4-14(25-2)5-7-15)10-13-8-17-18(9-16(13)20)28-12-27-17/h4-9H,3,10-12H2,1-2H3