(2,5-dimethoxyphenyl)methyl-[(4-morpholin-4-ylsulfonylphenyl)methyl]azanium

Systemtic Name: (2,5-dimethoxyphenyl)methyl-[(4-morpholin-4-ylsulfonylphenyl)methyl]azanium Openeye Name: (2,5-dimethoxyphenyl)methyl-[(4-morpholinosulfonylphenyl)methyl]ammonium CAS Name: (2,5-dimethoxyphenyl)methyl-[[4-(4-morpholinylsulfonyl)phenyl]methyl]ammonium IUPAC Name: (2,5-dimethoxyphenyl)methyl-[(4-morpholin-4-ylsulfonylphenyl)methyl]azanium Traditional Name: (2,5-dimethoxybenzyl)-(4-morpholinosulfonylbenzyl)ammonium Formula: C20H27N2O5S+ MolecularWeight: 407.50378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C[NH2+]CC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C[NH2+]CC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H26N2O5S/c1-25-18-5-8-20(26-2)17(13-18)15-21-14-16-3-6-19(7-4-16)28(23,24)22-9-11-27-12-10-22/h3-8,13,21H,9-12,14-15H2,1-2H3/p+1