[5-(1,3-dithiolan-2-yl)-3-methoxy-2-oxidanyl-phenyl]methyl-[(4-ethoxy-3-methoxy-phenyl)methyl]-methyl-azanium

Systemtic Name: [5-(1,3-dithiolan-2-yl)-3-methoxy-2-oxidanyl-phenyl]methyl-[(4-ethoxy-3-methoxy-phenyl)methyl]-methyl-azanium Openeye Name: [5-(1,3-dithiolan-2-yl)-2-hydroxy-3-methoxy-phenyl]methyl-[(4-ethoxy-3-methoxy-phenyl)methyl]-methyl-ammonium CAS Name: [5-(1,3-dithiolan-2-yl)-2-hydroxy-3-methoxyphenyl]methyl-[(4-ethoxy-3-methoxyphenyl)methyl]-methylammonium IUPAC Name: [5-(1,3-dithiolan-2-yl)-2-hydroxy-3-methoxyphenyl]methyl-[(4-ethoxy-3-methoxyphenyl)methyl]-methylazanium Traditional Name: [5-(1,3-dithiolan-2-yl)-2-hydroxy-3-methoxy-benzyl]-(4-ethoxy-3-methoxy-benzyl)-methyl-ammonium Formula: C22H30NO4S2+ MolecularWeight: 436.6079

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH+](C)CC2=C(C(=CC(=C2)C3SCCS3)OC)O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH+](C)CC2=C(C(=CC(=C2)C3SCCS3)OC)O)OC

InChI

InChI=1S/C22H29NO4S2/c1-5-27-18-7-6-15(10-19(18)25-3)13-23(2)14-17-11-16(22-28-8-9-29-22)12-20(26-4)21(17)24/h6-7,10-12,22,24H,5,8-9,13-14H2,1-4H3/p+1