ethyl 3-[furan-2-ylmethyl-(2,3,4,5,6-pentamethylphenyl)sulfonyl-amino]propanoate

Systemtic Name: ethyl 3-[furan-2-ylmethyl-(2,3,4,5,6-pentamethylphenyl)sulfonyl-amino]propanoate Openeye Name: ethyl 3-[2-furylmethyl-(2,3,4,5,6-pentamethylphenyl)sulfonyl-amino]propanoate CAS Name: 3-[2-furanylmethyl-(2,3,4,5,6-pentamethylphenyl)sulfonylamino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[furan-2-ylmethyl-(2,3,4,5,6-pentamethylphenyl)sulfonylamino]propanoate Traditional Name: 3-[2-furfuryl-(2,3,4,5,6-pentamethylphenyl)sulfonyl-amino]propionic acid ethyl ester Formula: C21H29NO5S MolecularWeight: 407.52366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CO1)S(=O)(=O)C2=C(C(=C(C(=C2C)C)C)C)C

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CO1)S(=O)(=O)C2=C(C(=C(C(=C2C)C)C)C)C

InChI

InChI=1S/C21H29NO5S/c1-7-26-20(23)10-11-22(13-19-9-8-12-27-19)28(24,25)21-17(5)15(3)14(2)16(4)18(21)6/h8-9,12H,7,10-11,13H2,1-6H3