[1-[3-(ethylsulfonylamino)phenyl]piperidin-4-yl]-[(1S)-2-methoxy-2-oxidanylidene-1-phenyl-ethyl]azanium

Systemtic Name: [1-[3-(ethylsulfonylamino)phenyl]piperidin-4-yl]-[(1S)-2-methoxy-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: [1-[3-(ethylsulfonylamino)phenyl]-4-piperidyl]-[(1S)-2-methoxy-2-oxo-1-phenyl-ethyl]ammonium CAS Name: [1-[3-(ethylsulfonylamino)phenyl]-4-piperidinyl]-[(1S)-2-methoxy-2-oxo-1-phenylethyl]ammonium IUPAC Name: [1-[3-(ethylsulfonylamino)phenyl]piperidin-4-yl]-[(1S)-2-methoxy-2-oxo-1-phenylethyl]azanium Traditional Name: [1-[3-(esylamino)phenyl]-4-piperidyl]-[(1S)-2-keto-2-methoxy-1-phenyl-ethyl]ammonium Formula: C22H30N3O4S+ MolecularWeight: 432.5563

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC=CC(=C1)N2CCC(CC2)[NH2+]C(C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCS(=O)(=O)NC1=CC=CC(=C1)N2CCC(CC2)[NH2+][C@@H](C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C22H29N3O4S/c1-3-30(27,28)24-19-10-7-11-20(16-19)25-14-12-18(13-15-25)23-21(22(26)29-2)17-8-5-4-6-9-17/h4-11,16,18,21,23-24H,3,12-15H2,1-2H3/p+1/t21-/m0/s1