(Z)-but-2-enedioate; [2-(2,4-dimethoxyphenyl)sulfanylphenyl]methanamine

Systemtic Name: (Z)-but-2-enedioate; [2-(2,4-dimethoxyphenyl)sulfanylphenyl]methanamine Openeye Name: (Z)-but-2-enedioate; [2-(2,4-dimethoxyphenyl)sulfanylphenyl]methanamine CAS Name: (Z)-2-butenedioate; [2-[(2,4-dimethoxyphenyl)thio]phenyl]methanamine IUPAC Name: (Z)-but-2-enedioate; [2-(2,4-dimethoxyphenyl)sulfanylphenyl]methanamine Traditional Name: [2-[(2,4-dimethoxyphenyl)thio]benzyl]amine maleate Formula: C19H19NO6S-2 MolecularWeight: 389.42226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)SC2=CC=CC=C2CN)OC.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)SC2=CC=CC=C2CN)OC.C(=C\C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C15H17NO2S.C4H4O4/c1-17-12-7-8-15(13(9-12)18-2)19-14-6-4-3-5-11(14)10-16;5-3(6)1-2-4(7)8/h3-9H,10,16H2,1-2H3;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1-