2-[4-[(E)-(pentylcarbamothioylhydrazinylidene)methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(E)-(pentylcarbamothioylhydrazinylidene)methyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[(E)-(pentylcarbamothioylhydrazono)methyl]phenoxy]acetic acid CAS Name: 2-[4-[(E)-[[(pentylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenoxy]acetic acid IUPAC Name: 2-[4-[(E)-(pentylcarbamothioylhydrazinylidene)methyl]phenoxy]acetic acid Traditional Name: 2-[4-[(E)-(amylthiocarbamoylhydrazono)methyl]phenoxy]acetic acid Formula: C15H21N3O3S MolecularWeight: 323.41054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NN=CC1=CC=C(C=C1)OCC(=O)O

Isomeric SMILES

CCCCCNC(=S)N/N=C/C1=CC=C(C=C1)OCC(=O)O

InChI

InChI=1S/C15H21N3O3S/c1-2-3-4-9-16-15(22)18-17-10-12-5-7-13(8-6-12)21-11-14(19)20/h5-8,10H,2-4,9,11H2,1H3,(H,19,20)(H2,16,18,22)/b17-10+