[2-[di(propan-2-yl)amino]-2-oxidanylidene-ethyl] (2S)-1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: [2-[di(propan-2-yl)amino]-2-oxidanylidene-ethyl] (2S)-1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: [2-(diisopropylamino)-2-oxo-ethyl] (2S)-1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: (2S)-1-(4-methoxyphenyl)sulfonyl-2-pyrrolidinecarboxylic acid [2-[di(propan-2-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[di(propan-2-yl)amino]-2-oxoethyl] (2S)-1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carboxylic acid [2-(diisopropylamino)-2-keto-ethyl] ester Formula: C20H30N2O6S MolecularWeight: 426.527

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)COC(=O)C1CCCN1S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)N(C(C)C)C(=O)COC(=O)[C@@H]1CCCN1S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H30N2O6S/c1-14(2)22(15(3)4)19(23)13-28-20(24)18-7-6-12-21(18)29(25,26)17-10-8-16(27-5)9-11-17/h8-11,14-15,18H,6-7,12-13H2,1-5H3/t18-/m0/s1