methyl N-[4-[4-[(4-iodanyl-2-methyl-phenyl)carbamoyl]piperidin-1-yl]sulfonylphenyl]carbamate

Systemtic Name: methyl N-[4-[4-[(4-iodanyl-2-methyl-phenyl)carbamoyl]piperidin-1-yl]sulfonylphenyl]carbamate Openeye Name: methyl N-[4-[[4-[(4-iodo-2-methyl-phenyl)carbamoyl]-1-piperidyl]sulfonyl]phenyl]carbamate CAS Name: N-[4-[[4-[(4-iodo-2-methylanilino)-oxomethyl]-1-piperidinyl]sulfonyl]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[4-[4-[(4-iodo-2-methylphenyl)carbamoyl]piperidin-1-yl]sulfonylphenyl]carbamate Traditional Name: N-[4-[4-[(4-iodo-2-methyl-phenyl)carbamoyl]piperidino]sulfonylphenyl]carbamic acid methyl ester Formula: C21H24IN3O5S MolecularWeight: 557.40183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)OC

InChI

InChI=1S/C21H24IN3O5S/c1-14-13-16(22)3-8-19(14)24-20(26)15-9-11-25(12-10-15)31(28,29)18-6-4-17(5-7-18)23-21(27)30-2/h3-8,13,15H,9-12H2,1-2H3,(H,23,27)(H,24,26)