[1-(3-fluorophenyl)sulfonyl-4-methyl-piperidin-2-yl] (2S)-2-azanyl-3-(4-fluorophenyl)propanoate

Systemtic Name: [1-(3-fluorophenyl)sulfonyl-4-methyl-piperidin-2-yl] (2S)-2-azanyl-3-(4-fluorophenyl)propanoate Openeye Name: [1-(3-fluorophenyl)sulfonyl-4-methyl-2-piperidyl] (2S)-2-amino-3-(4-fluorophenyl)propanoate CAS Name: (2S)-2-amino-3-(4-fluorophenyl)propanoic acid [1-(3-fluorophenyl)sulfonyl-4-methyl-2-piperidinyl] ester IUPAC Name: [1-(3-fluorophenyl)sulfonyl-4-methylpiperidin-2-yl] (2S)-2-amino-3-(4-fluorophenyl)propanoate Traditional Name: (2S)-2-amino-3-(4-fluorophenyl)propionic acid [1-(3-fluorophenyl)sulfonyl-4-methyl-2-piperidyl] ester Formula: C21H24F2N2O4S MolecularWeight: 438.488066

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C(C1)OC(=O)C(CC2=CC=C(C=C2)F)N)S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

CC1CCN(C(C1)OC(=O)[C@H](CC2=CC=C(C=C2)F)N)S(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C21H24F2N2O4S/c1-14-9-10-25(30(27,28)18-4-2-3-17(23)13-18)20(11-14)29-21(26)19(24)12-15-5-7-16(22)8-6-15/h2-8,13-14,19-20H,9-12,24H2,1H3/t14?,19-,20?/m0/s1