azanyl 3-methyl-2-(2-phenylmethoxyphenyl)-2-piperazin-1-ylsulfonyl-butanoate

Systemtic Name: azanyl 3-methyl-2-(2-phenylmethoxyphenyl)-2-piperazin-1-ylsulfonyl-butanoate Openeye Name: amino 2-(2-benzyloxyphenyl)-3-methyl-2-piperazin-1-ylsulfonyl-butanoate CAS Name: 3-methyl-2-(2-phenylmethoxyphenyl)-2-(1-piperazinylsulfonyl)butanoic acid amino ester IUPAC Name: amino 3-methyl-2-(2-phenylmethoxyphenyl)-2-piperazin-1-ylsulfonylbutanoate Traditional Name: 2-(2-benzoxyphenyl)-3-methyl-2-piperazinosulfonyl-butyric acid amino ester Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CC=C1OCC2=CC=CC=C2)(C(=O)ON)S(=O)(=O)N3CCNCC3

Isomeric SMILES

CC(C)C(C1=CC=CC=C1OCC2=CC=CC=C2)(C(=O)ON)S(=O)(=O)N3CCNCC3

InChI

InChI=1S/C22H29N3O5S/c1-17(2)22(21(26)30-23,31(27,28)25-14-12-24-13-15-25)19-10-6-7-11-20(19)29-16-18-8-4-3-5-9-18/h3-11,17,24H,12-16,23H2,1-2H3