methyl (2S)-2-[[1-[3-(ethylsulfonylamino)phenyl]piperidin-4-yl]amino]-2-phenyl-ethanoate

Systemtic Name: methyl (2S)-2-[[1-[3-(ethylsulfonylamino)phenyl]piperidin-4-yl]amino]-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-[[1-[3-(ethylsulfonylamino)phenyl]-4-piperidyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[1-[3-(ethylsulfonylamino)phenyl]-4-piperidinyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-[[1-[3-(ethylsulfonylamino)phenyl]piperidin-4-yl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[1-[3-(esylamino)phenyl]-4-piperidyl]amino]-2-phenyl-acetic acid methyl ester Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC=CC(=C1)N2CCC(CC2)NC(C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCS(=O)(=O)NC1=CC=CC(=C1)N2CCC(CC2)N[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/t21-/m0/s1