methyl N-[4-[3-[(2-methylphenyl)carbamoyl]piperidin-1-yl]sulfonylphenyl]carbamate

Systemtic Name: methyl N-[4-[3-[(2-methylphenyl)carbamoyl]piperidin-1-yl]sulfonylphenyl]carbamate Openeye Name: methyl N-[4-[[3-(o-tolylcarbamoyl)-1-piperidyl]sulfonyl]phenyl]carbamate CAS Name: N-[4-[[3-[(2-methylanilino)-oxomethyl]-1-piperidinyl]sulfonyl]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[4-[3-[(2-methylphenyl)carbamoyl]piperidin-1-yl]sulfonylphenyl]carbamate Traditional Name: N-[4-[3-(o-tolylcarbamoyl)piperidino]sulfonylphenyl]carbamic acid methyl ester Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)OC

InChI

InChI=1S/C21H25N3O5S/c1-15-6-3-4-8-19(15)23-20(25)16-7-5-13-24(14-16)30(27,28)18-11-9-17(10-12-18)22-21(26)29-2/h3-4,6,8-12,16H,5,7,13-14H2,1-2H3,(H,22,26)(H,23,25)