6-[(4-methoxyphenyl)carbothioylamino]hexanoic acid

Systemtic Name: 6-[(4-methoxyphenyl)carbothioylamino]hexanoic acid Openeye Name: 6-[(4-methoxybenzenecarbothioyl)amino]hexanoic acid CAS Name: 6-[[(4-methoxyphenyl)-sulfanylidenemethyl]amino]hexanoic acid IUPAC Name: 6-[(4-methoxybenzenecarbothioyl)amino]hexanoic acid Traditional Name: 6-[(4-methoxythiobenzoyl)amino]hexanoic acid Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=S)NCCCCCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=S)NCCCCCC(=O)O

InChI

InChI=1S/C14H19NO3S/c1-18-12-8-6-11(7-9-12)14(19)15-10-4-2-3-5-13(16)17/h6-9H,2-5,10H2,1H3,(H,15,19)(H,16,17)