ethyl 3-[(4-but-3-enoxyphenyl)carbonyl-methylsulfonyl-amino]benzoate

Systemtic Name: ethyl 3-[(4-but-3-enoxyphenyl)carbonyl-methylsulfonyl-amino]benzoate Openeye Name: ethyl 3-[(4-but-3-enoxybenzoyl)-methylsulfonyl-amino]benzoate CAS Name: 3-[[(4-but-3-enoxyphenyl)-oxomethyl]-methylsulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(4-but-3-enoxybenzoyl)-methylsulfonylamino]benzoate Traditional Name: 3-[(4-but-3-enoxybenzoyl)-mesyl-amino]benzoic acid ethyl ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)N(C(=O)C2=CC=C(C=C2)OCCC=C)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)N(C(=O)C2=CC=C(C=C2)OCCC=C)S(=O)(=O)C

InChI

InChI=1S/C21H23NO6S/c1-4-6-14-28-19-12-10-16(11-13-19)20(23)22(29(3,25)26)18-9-7-8-17(15-18)21(24)27-5-2/h4,7-13,15H,1,5-6,14H2,2-3H3