[(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl] 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl] 4-piperidin-1-ylsulfonylbenzoate Openeye Name: [(1R)-1-(benzylcarbamoyl)propyl] 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid [(2R)-1-oxo-1-[(phenylmethyl)amino]butan-2-yl] ester IUPAC Name: [(2R)-1-(benzylamino)-1-oxobutan-2-yl] 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid [(1R)-1-(benzylcarbamoyl)propyl] ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC[C@H](C(=O)NCC1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H28N2O5S/c1-2-21(22(26)24-17-18-9-5-3-6-10-18)30-23(27)19-11-13-20(14-12-19)31(28,29)25-15-7-4-8-16-25/h3,5-6,9-14,21H,2,4,7-8,15-17H2,1H3,(H,24,26)/t21-/m1/s1