(3-morpholin-4-ylsulfonylphenyl)methyl 3-[(4-tert-butylphenyl)carbonylamino]propanoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-[(4-tert-butylphenyl)carbonylamino]propanoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 3-[(4-tert-butylbenzoyl)amino]propanoate CAS Name: 3-[[(4-tert-butylphenyl)-oxomethyl]amino]propanoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-[(4-tert-butylbenzoyl)amino]propanoate Traditional Name: 3-[(4-tert-butylbenzoyl)amino]propionic acid (3-morpholinosulfonylbenzyl) ester Formula: C25H32N2O6S MolecularWeight: 488.59638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCC(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCC(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C25H32N2O6S/c1-25(2,3)21-9-7-20(8-10-21)24(29)26-12-11-23(28)33-18-19-5-4-6-22(17-19)34(30,31)27-13-15-32-16-14-27/h4-10,17H,11-16,18H2,1-3H3,(H,26,29)