[2-oxidanylidene-2-(2-phenylpropylamino)ethyl] 4-methyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylpropylamino)ethyl] 4-methyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: [2-oxo-2-(2-phenylpropylamino)ethyl] 4-methyl-3-morpholinosulfonyl-benzoate CAS Name: 4-methyl-3-(4-morpholinylsulfonyl)benzoic acid [2-oxo-2-(2-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylpropylamino)ethyl] 4-methyl-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methyl-3-morpholinosulfonyl-benzoic acid [2-keto-2-(2-phenylpropylamino)ethyl] ester Formula: C23H28N2O6S MolecularWeight: 460.54322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCC(C)C2=CC=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCC(C)C2=CC=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C23H28N2O6S/c1-17-8-9-20(14-21(17)32(28,29)25-10-12-30-13-11-25)23(27)31-16-22(26)24-15-18(2)19-6-4-3-5-7-19/h3-9,14,18H,10-13,15-16H2,1-2H3,(H,24,26)