methyl 3-[[3-oxidanylidene-3-(1-phenylethylamino)propyl]sulfonylmethyl]benzoate

Systemtic Name: methyl 3-[[3-oxidanylidene-3-(1-phenylethylamino)propyl]sulfonylmethyl]benzoate Openeye Name: methyl 3-[[3-oxo-3-(1-phenylethylamino)propyl]sulfonylmethyl]benzoate CAS Name: 3-[[3-oxo-3-(1-phenylethylamino)propyl]sulfonylmethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[3-oxo-3-(1-phenylethylamino)propyl]sulfonylmethyl]benzoate Traditional Name: 3-[[3-keto-3-(1-phenylethylamino)propyl]sulfonylmethyl]benzoic acid methyl ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CCS(=O)(=O)CC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)CCS(=O)(=O)CC2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C20H23NO5S/c1-15(17-8-4-3-5-9-17)21-19(22)11-12-27(24,25)14-16-7-6-10-18(13-16)20(23)26-2/h3-10,13,15H,11-12,14H2,1-2H3,(H,21,22)