ethyl 4-[3-[(2-methylphenyl)methylsulfonyl]propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[(2-methylphenyl)methylsulfonyl]propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(o-tolylmethylsulfonyl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-[(2-methylphenyl)methylsulfonyl]-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(2-methylphenyl)methylsulfonyl]propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(2-methylbenzyl)sulfonylpropanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CCS(=O)(=O)CC2=CC=CC=C2C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CCS(=O)(=O)CC2=CC=CC=C2C

InChI

InChI=1S/C18H26N2O5S/c1-3-25-18(22)20-11-9-19(10-12-20)17(21)8-13-26(23,24)14-16-7-5-4-6-15(16)2/h4-7H,3,8-14H2,1-2H3