methyl (2R,4Z)-1-(4-butoxyphenyl)sulfonyl-4-phenylmethoxyimino-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2R,4Z)-1-(4-butoxyphenyl)sulfonyl-4-phenylmethoxyimino-pyrrolidine-2-carboxylate Openeye Name: methyl (2R,4Z)-4-benzyloxyimino-1-(4-butoxyphenyl)sulfonyl-pyrrolidine-2-carboxylate CAS Name: (2R,4Z)-1-(4-butoxyphenyl)sulfonyl-4-phenylmethoxyimino-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,4Z)-1-(4-butoxyphenyl)sulfonyl-4-phenylmethoxyiminopyrrolidine-2-carboxylate Traditional Name: (2R,4Z)-4-benzyloximino-1-(4-butoxyphenyl)sulfonyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C23H28N2O6S MolecularWeight: 460.54322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CC(=NOCC3=CC=CC=C3)CC2C(=O)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2C/C(=N\OCC3=CC=CC=C3)/C[C@@H]2C(=O)OC

InChI

InChI=1S/C23H28N2O6S/c1-3-4-14-30-20-10-12-21(13-11-20)32(27,28)25-16-19(15-22(25)23(26)29-2)24-31-17-18-8-6-5-7-9-18/h5-13,22H,3-4,14-17H2,1-2H3/b24-19-/t22-/m1/s1