2-(1,3-benzodithiol-2-ylideneamino)butanoic acid

Systemtic Name: 2-(1,3-benzodithiol-2-ylideneamino)butanoic acid Openeye Name: 2-(1,3-benzodithiol-2-ylideneamino)butanoic acid CAS Name: 2-(1,3-benzodithiol-2-ylideneamino)butanoic acid IUPAC Name: 2-(1,3-benzodithiol-2-ylideneamino)butanoic acid Traditional Name: 2-(1,3-benzodithiol-2-ylideneamino)butyric acid Formula: C11H11NO2S2 MolecularWeight: 253.34054

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N=C1SC2=CC=CC=C2S1

Isomeric SMILES

CCC(C(=O)O)N=C1SC2=CC=CC=C2S1

InChI

InChI=1S/C11H11NO2S2/c1-2-7(10(13)14)12-11-15-8-5-3-4-6-9(8)16-11/h3-7H,2H2,1H3,(H,13,14)