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(Z)-but-2-enedioate; 1-[(2-phenylsulfanylphenyl)methyl]piperidine

(Z)-but-2-enedioate; 1-[(2-phenylsulfanylphenyl)methyl]piperidine

Systemtic Name:(Z)-but-2-enedioate; 1-[(2-phenylsulfanylphenyl)methyl]piperidine
Openeye Name:(Z)-but-2-enedioate; 1-[(2-phenylsulfanylphenyl)methyl]piperidine
CAS Name:(Z)-2-butenedioate; 1-[[2-(phenylthio)phenyl]methyl]piperidine
IUPAC Name:(Z)-but-2-enedioate; 1-[(2-phenylsulfanylphenyl)methyl]piperidine
Traditional Name:1-[2-(phenylthio)benzyl]piperidine maleate
Formula: C22H23NO4S-2
MolecularWeight: 397.48732
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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=CC=C2SC3=CC=CC=C3.C(=CC(=O)[O-])C(=O)[O-]


Isomeric SMILES

C1CCN(CC1)CC2=CC=CC=C2SC3=CC=CC=C3.C(=C\C(=O)[O-])\C(=O)[O-]


InChI

InChI=1S/C18H21NS.C4H4O4/c1-3-10-17(11-4-1)20-18-12-6-5-9-16(18)15-19-13-7-2-8-14-19;5-3(6)1-2-4(7)8/h1,3-6,9-12H,2,7-8,13-15H2;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1-


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