[(2R)-4-(phenylmethyl)morpholin-4-ium-2-yl]methyl N-(4-methylphenyl)sulfonylcarbamate

Systemtic Name: [(2R)-4-(phenylmethyl)morpholin-4-ium-2-yl]methyl N-(4-methylphenyl)sulfonylcarbamate Openeye Name: [(2R)-4-benzylmorpholin-4-ium-2-yl]methyl N-(p-tolylsulfonyl)carbamate CAS Name: N-(4-methylphenyl)sulfonylcarbamic acid [(2R)-4-(phenylmethyl)-2-morpholin-4-iumyl]methyl ester IUPAC Name: [(2R)-4-benzylmorpholin-4-ium-2-yl]methyl N-(4-methylphenyl)sulfonylcarbamate Traditional Name: N-tosylcarbamic acid [(2R)-4-benzylmorpholin-4-ium-2-yl]methyl ester Formula: C20H25N2O5S+ MolecularWeight: 405.4879

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)OCC2C[NH+](CCO2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)OC[C@H]2C[NH+](CCO2)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O5S/c1-16-7-9-19(10-8-16)28(24,25)21-20(23)27-15-18-14-22(11-12-26-18)13-17-5-3-2-4-6-17/h2-10,18H,11-15H2,1H3,(H,21,23)/p+1/t18-/m1/s1