[2-oxidanylidene-2-(1-phenylbutylamino)ethyl] 3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-(1-phenylbutylamino)ethyl] 3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Openeye Name: [2-oxo-2-(1-phenylbutylamino)ethyl] 3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate CAS Name: 3-[(2,6-dimethyl-4-morpholinyl)sulfonyl]benzoic acid [2-oxo-2-(1-phenylbutylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1-phenylbutylamino)ethyl] 3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Traditional Name: 3-(2,6-dimethylmorpholino)sulfonylbenzoic acid [2-keto-2-(1-phenylbutylamino)ethyl] ester Formula: C25H32N2O6S MolecularWeight: 488.59638

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CC(OC(C3)C)C

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CC(OC(C3)C)C

InChI

InChI=1S/C25H32N2O6S/c1-4-9-23(20-10-6-5-7-11-20)26-24(28)17-32-25(29)21-12-8-13-22(14-21)34(30,31)27-15-18(2)33-19(3)16-27/h5-8,10-14,18-19,23H,4,9,15-17H2,1-3H3,(H,26,28)