tert-butyl 4-naphthalen-1-ylcarbonyl-2-[2-(phenylsulfonyl)ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-naphthalen-1-ylcarbonyl-2-[2-(phenylsulfonyl)ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 2-[2-(benzenesulfonyl)ethyl]-4-(naphthalene-1-carbonyl)piperazine-1-carboxylate CAS Name: 2-[2-(benzenesulfonyl)ethyl]-4-[1-naphthalenyl(oxo)methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-(benzenesulfonyl)ethyl]-4-(naphthalene-1-carbonyl)piperazine-1-carboxylate Traditional Name: 2-(2-besylethyl)-4-(1-naphthoyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C28H32N2O5S MolecularWeight: 508.62908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1CCS(=O)(=O)C2=CC=CC=C2)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1CCS(=O)(=O)C2=CC=CC=C2)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H32N2O5S/c1-28(2,3)35-27(32)30-18-17-29(26(31)25-15-9-11-21-10-7-8-14-24(21)25)20-22(30)16-19-36(33,34)23-12-5-4-6-13-23/h4-15,22H,16-20H2,1-3H3