tert-butyl N-[1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-3-piperidin-1-ylsulfonyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-3-piperidin-1-ylsulfonyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-[(4-methoxyphenyl)methylamino]-2-oxo-1-(1-piperidylsulfonylmethyl)ethyl]carbamate CAS Name: N-[1-[(4-methoxyphenyl)methylamino]-1-oxo-3-(1-piperidinylsulfonyl)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[(4-methoxyphenyl)methylamino]-1-oxo-3-piperidin-1-ylsulfonylpropan-2-yl]carbamate Traditional Name: N-[2-keto-2-(p-anisylamino)-1-(piperidinosulfonylmethyl)ethyl]carbamic acid tert-butyl ester Formula: C21H33N3O6S MolecularWeight: 455.56822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CS(=O)(=O)N1CCCCC1)C(=O)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CS(=O)(=O)N1CCCCC1)C(=O)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H33N3O6S/c1-21(2,3)30-20(26)23-18(15-31(27,28)24-12-6-5-7-13-24)19(25)22-14-16-8-10-17(29-4)11-9-16/h8-11,18H,5-7,12-15H2,1-4H3,(H,22,25)(H,23,26)