tert-butyl 3-[(4-morpholin-4-ylsulfonylphenyl)methylcarbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(4-morpholin-4-ylsulfonylphenyl)methylcarbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(4-morpholinosulfonylphenyl)methylcarbamoyl]piperidine-1-carboxylate CAS Name: 3-[[[4-(4-morpholinylsulfonyl)phenyl]methylamino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(4-morpholin-4-ylsulfonylphenyl)methylcarbamoyl]piperidine-1-carboxylate Traditional Name: 3-[(4-morpholinosulfonylbenzyl)carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H33N3O6S MolecularWeight: 467.57892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H33N3O6S/c1-22(2,3)31-21(27)24-10-4-5-18(16-24)20(26)23-15-17-6-8-19(9-7-17)32(28,29)25-11-13-30-14-12-25/h6-9,18H,4-5,10-16H2,1-3H3,(H,23,26)