(1-oxidanylidene-1-phenylazanyl-butan-2-yl) 2-methylsulfonylbenzoate

Systemtic Name: (1-oxidanylidene-1-phenylazanyl-butan-2-yl) 2-methylsulfonylbenzoate Openeye Name: 1-(phenylcarbamoyl)propyl 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic acid (1-anilino-1-oxobutan-2-yl) ester IUPAC Name: (1-anilino-1-oxobutan-2-yl) 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid 1-(phenylcarbamoyl)propyl ester Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)OC(=O)C2=CC=CC=C2S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1)OC(=O)C2=CC=CC=C2S(=O)(=O)C

InChI

InChI=1S/C18H19NO5S/c1-3-15(17(20)19-13-9-5-4-6-10-13)24-18(21)14-11-7-8-12-16(14)25(2,22)23/h4-12,15H,3H2,1-2H3,(H,19,20)