(Z)-but-2-enedioate; N-methyl-1-[2-(phenylsulfinyl)phenyl]propan-2-amine

Systemtic Name: (Z)-but-2-enedioate; N-methyl-1-[2-(phenylsulfinyl)phenyl]propan-2-amine Openeye Name: 1-[2-(benzenesulfinyl)phenyl]-N-methyl-propan-2-amine; (Z)-but-2-enedioate CAS Name: 1-[2-(benzenesulfinyl)phenyl]-N-methyl-2-propanamine; (Z)-2-butenedioate IUPAC Name: 1-[2-(benzenesulfinyl)phenyl]-N-methylpropan-2-amine; (Z)-but-2-enedioate Traditional Name: [2-[2-(benzenesulfinyl)phenyl]-1-methyl-ethyl]-methyl-amine maleate Formula: C20H21NO5S-2 MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1S(=O)C2=CC=CC=C2)NC.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(CC1=CC=CC=C1S(=O)C2=CC=CC=C2)NC.C(=C\C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C16H19NOS.C4H4O4/c1-13(17-2)12-14-8-6-7-11-16(14)19(18)15-9-4-3-5-10-15;5-3(6)1-2-4(7)8/h3-11,13,17H,12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1-