(Z)-but-2-enedioate; 1-[2-(2,5-dimethoxyphenyl)sulfanylphenyl]-N,N-dimethyl-methanamine

Systemtic Name: (Z)-but-2-enedioate; 1-[2-(2,5-dimethoxyphenyl)sulfanylphenyl]-N,N-dimethyl-methanamine Openeye Name: (Z)-but-2-enedioate; 1-[2-(2,5-dimethoxyphenyl)sulfanylphenyl]-N,N-dimethyl-methanamine CAS Name: (Z)-2-butenedioate; 1-[2-[(2,5-dimethoxyphenyl)thio]phenyl]-N,N-dimethylmethanamine IUPAC Name: (Z)-but-2-enedioate; 1-[2-(2,5-dimethoxyphenyl)sulfanylphenyl]-N,N-dimethylmethanamine Traditional Name: [2-[(2,5-dimethoxyphenyl)thio]benzyl]-dimethyl-amine maleate Formula: C21H23NO6S-2 MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1SC2=C(C=CC(=C2)OC)OC.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CN(C)CC1=CC=CC=C1SC2=C(C=CC(=C2)OC)OC.C(=C\C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C17H21NO2S.C4H4O4/c1-18(2)12-13-7-5-6-8-16(13)21-17-11-14(19-3)9-10-15(17)20-4;5-3(6)1-2-4(7)8/h5-11H,12H2,1-4H3;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1-