[(2S)-1-[(4-morpholin-4-ylsulfonylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-phenoxybenzoate

Systemtic Name: [(2S)-1-[(4-morpholin-4-ylsulfonylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-phenoxybenzoate Openeye Name: [(1S)-1-methyl-2-(4-morpholinosulfonylanilino)-2-oxo-ethyl] 4-phenoxybenzoate CAS Name: 4-phenoxybenzoic acid [(2S)-1-[4-(4-morpholinylsulfonyl)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-morpholin-4-ylsulfonylanilino)-1-oxopropan-2-yl] 4-phenoxybenzoate Traditional Name: 4-phenoxybenzoic acid [(1S)-2-keto-1-methyl-2-(4-morpholinosulfonylanilino)ethyl] ester Formula: C26H26N2O7S MolecularWeight: 510.55884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)OC(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)OC(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H26N2O7S/c1-19(34-26(30)20-7-11-23(12-8-20)35-22-5-3-2-4-6-22)25(29)27-21-9-13-24(14-10-21)36(31,32)28-15-17-33-18-16-28/h2-14,19H,15-18H2,1H3,(H,27,29)/t19-/m0/s1