tert-butyl N-[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-piperazin-1-yl]carbamate

Systemtic Name: tert-butyl N-[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-piperazin-1-yl]carbamate Openeye Name: tert-butyl N-[4-[(6-chloro-2-naphthyl)sulfonyl]-2-oxo-piperazin-1-yl]carbamate CAS Name: N-[4-[(6-chloro-2-naphthalenyl)sulfonyl]-2-oxo-1-piperazinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(6-chloronaphthalen-2-yl)sulfonyl-2-oxopiperazin-1-yl]carbamate Traditional Name: N-[4-[(6-chloro-2-naphthyl)sulfonyl]-2-keto-piperazino]carbamic acid tert-butyl ester Formula: C19H22ClN3O5S MolecularWeight: 439.91308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN1CCN(CC1=O)S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NN1CCN(CC1=O)S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl

InChI

InChI=1S/C19H22ClN3O5S/c1-19(2,3)28-18(25)21-23-9-8-22(12-17(23)24)29(26,27)16-7-5-13-10-15(20)6-4-14(13)11-16/h4-7,10-11H,8-9,12H2,1-3H3,(H,21,25)