ethyl 3-[[4-[methylsulfonyl(prop-2-enyl)amino]phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[4-[methylsulfonyl(prop-2-enyl)amino]phenyl]carbonylamino]benzoate Openeye Name: ethyl 3-[[4-[allyl(methylsulfonyl)amino]benzoyl]amino]benzoate CAS Name: 3-[[[4-[methylsulfonyl(prop-2-enyl)amino]phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-[methylsulfonyl(prop-2-enyl)amino]benzoyl]amino]benzoate Traditional Name: 3-[[4-[allyl(mesyl)amino]benzoyl]amino]benzoic acid ethyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O5S/c1-4-13-22(28(3,25)26)18-11-9-15(10-12-18)19(23)21-17-8-6-7-16(14-17)20(24)27-5-2/h4,6-12,14H,1,5,13H2,2-3H3,(H,21,23)