methyl 4-[4-[1-[(4-methylphenyl)sulfonylamino]-2-phenyl-ethyl]phenyl]butanoate

Systemtic Name: methyl 4-[4-[1-[(4-methylphenyl)sulfonylamino]-2-phenyl-ethyl]phenyl]butanoate Openeye Name: methyl 4-[4-[2-phenyl-1-(p-tolylsulfonylamino)ethyl]phenyl]butanoate CAS Name: 4-[4-[1-[(4-methylphenyl)sulfonylamino]-2-phenylethyl]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[1-[(4-methylphenyl)sulfonylamino]-2-phenylethyl]phenyl]butanoate Traditional Name: 4-[4-[2-phenyl-1-(tosylamino)ethyl]phenyl]butyric acid methyl ester Formula: C26H29NO4S MolecularWeight: 451.57776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C3=CC=C(C=C3)CCCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C3=CC=C(C=C3)CCCC(=O)OC

InChI

InChI=1S/C26H29NO4S/c1-20-11-17-24(18-12-20)32(29,30)27-25(19-22-7-4-3-5-8-22)23-15-13-21(14-16-23)9-6-10-26(28)31-2/h3-5,7-8,11-18,25,27H,6,9-10,19H2,1-2H3