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2-[(E)-(cyclooctylcarbamothioylhydrazinylidene)methyl]benzoic acid

2-[(E)-(cyclooctylcarbamothioylhydrazinylidene)methyl]benzoic acid

Systemtic Name:2-[(E)-(cyclooctylcarbamothioylhydrazinylidene)methyl]benzoic acid
Openeye Name:2-[(E)-(cyclooctylcarbamothioylhydrazono)methyl]benzoic acid
CAS Name:2-[(E)-[[(cyclooctylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]benzoic acid
IUPAC Name:2-[(E)-(cyclooctylcarbamothioylhydrazinylidene)methyl]benzoic acid
Traditional Name:2-[(E)-(cyclooctylthiocarbamoylhydrazono)methyl]benzoic acid
Formula: C17H23N3O2S
MolecularWeight: 333.44842
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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=S)NN=CC2=CC=CC=C2C(=O)O


Isomeric SMILES

C1CCCC(CCC1)NC(=S)N/N=C/C2=CC=CC=C2C(=O)O


InChI

InChI=1S/C17H23N3O2S/c21-16(22)15-11-7-6-8-13(15)12-18-20-17(23)19-14-9-4-2-1-3-5-10-14/h6-8,11-12,14H,1-5,9-10H2,(H,21,22)(H2,19,20,23)/b18-12+


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