methyl 7-[(4-methoxyphenyl)methyl-(4-methylphenyl)sulfonyl-amino]-3-oxidanylidene-heptanoate

Systemtic Name: methyl 7-[(4-methoxyphenyl)methyl-(4-methylphenyl)sulfonyl-amino]-3-oxidanylidene-heptanoate Openeye Name: methyl 7-[(4-methoxyphenyl)methyl-(p-tolylsulfonyl)amino]-3-oxo-heptanoate CAS Name: 7-[(4-methoxyphenyl)methyl-(4-methylphenyl)sulfonylamino]-3-oxoheptanoic acid methyl ester IUPAC Name: methyl 7-[(4-methoxyphenyl)methyl-(4-methylphenyl)sulfonylamino]-3-oxoheptanoate Traditional Name: 3-keto-7-[p-anisyl(tosyl)amino]enanthic acid methyl ester Formula: C23H29NO6S MolecularWeight: 447.54446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29NO6S/c1-18-7-13-22(14-8-18)31(27,28)24(17-19-9-11-21(29-2)12-10-19)15-5-4-6-20(25)16-23(26)30-3/h7-14H,4-6,15-17H2,1-3H3