tert-butyl 2-[(4-hydroxyphenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]-3-(1-methylpyrrolidin-2-yl)-3-oxidanylidene-propanoate

Systemtic Name: tert-butyl 2-[(4-hydroxyphenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]-3-(1-methylpyrrolidin-2-yl)-3-oxidanylidene-propanoate Openeye Name: tert-butyl 2-[(4-hydroxyphenyl)methyl]-3-(1-methylpyrrolidin-2-yl)-3-oxo-2-(p-tolylsulfonylamino)propanoate CAS Name: 2-[(4-hydroxyphenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]-3-(1-methyl-2-pyrrolidinyl)-3-oxopropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-hydroxyphenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]-3-(1-methylpyrrolidin-2-yl)-3-oxopropanoate Traditional Name: 2-(4-hydroxybenzyl)-3-keto-3-(1-methylpyrrolidin-2-yl)-2-(tosylamino)propionic acid tert-butyl ester Formula: C26H34N2O6S MolecularWeight: 502.62296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=C(C=C2)O)(C(=O)C3CCCN3C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=C(C=C2)O)(C(=O)C3CCCN3C)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H34N2O6S/c1-18-8-14-21(15-9-18)35(32,33)27-26(24(31)34-25(2,3)4,17-19-10-12-20(29)13-11-19)23(30)22-7-6-16-28(22)5/h8-15,22,27,29H,6-7,16-17H2,1-5H3