(2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 4-methyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 4-methyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: (2-morpholino-2-oxo-1-phenyl-ethyl) 4-methyl-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-methyl-3-(1-piperidinylsulfonyl)benzoic acid [2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxo-1-phenylethyl) 4-methyl-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-methyl-3-piperidinosulfonyl-benzoic acid (2-keto-2-morpholino-1-phenyl-ethyl) ester Formula: C25H30N2O6S MolecularWeight: 486.5805

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCOCC3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCOCC3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C25H30N2O6S/c1-19-10-11-21(18-22(19)34(30,31)27-12-6-3-7-13-27)25(29)33-23(20-8-4-2-5-9-20)24(28)26-14-16-32-17-15-26/h2,4-5,8-11,18,23H,3,6-7,12-17H2,1H3