methyl 2-[(4-methylphenyl)sulfonyl-[3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-prop-1-ynyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(4-methylphenyl)sulfonyl-[3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-prop-1-ynyl]amino]-3-phenyl-propanoate Openeye Name: methyl 2-[(3-tert-butoxy-3-oxo-prop-1-ynyl)-(p-tolylsulfonyl)amino]-3-phenyl-propanoate CAS Name: 2-[(4-methylphenyl)sulfonyl-[3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-ynyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(4-methylphenyl)sulfonyl-[3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-ynyl]amino]-3-phenylpropanoate Traditional Name: 2-[(3-tert-butoxy-3-keto-prop-1-ynyl)-tosyl-amino]-3-phenyl-propionic acid methyl ester Formula: C24H27NO6S MolecularWeight: 457.53928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C#CC(=O)OC(C)(C)C)C(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C#CC(=O)OC(C)(C)C)C(CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C24H27NO6S/c1-18-11-13-20(14-12-18)32(28,29)25(16-15-22(26)31-24(2,3)4)21(23(27)30-5)17-19-9-7-6-8-10-19/h6-14,21H,17H2,1-5H3