(phenylmethyl) 2-(2-diethylaminoethylsulfonylmethyl)-3-phenyl-propanoate

Systemtic Name: (phenylmethyl) 2-(2-diethylaminoethylsulfonylmethyl)-3-phenyl-propanoate Openeye Name: benzyl 2-benzyl-3-(2-diethylaminoethylsulfonyl)propanoate CAS Name: 2-(2-diethylaminoethylsulfonylmethyl)-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-benzyl-3-(2-diethylaminoethylsulfonyl)propanoate Traditional Name: 2-benzyl-3-(2-diethylaminoethylsulfonyl)propionic acid benzyl ester Formula: C23H31NO4S MolecularWeight: 417.56154

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCS(=O)(=O)CC(CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCN(CC)CCS(=O)(=O)CC(CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H31NO4S/c1-3-24(4-2)15-16-29(26,27)19-22(17-20-11-7-5-8-12-20)23(25)28-18-21-13-9-6-10-14-21/h5-14,22H,3-4,15-19H2,1-2H3