4-[(Z)-2-(2,2-dimethyl-1,3-benzodithiol-5-yl)prop-1-enyl]benzoic acid

Systemtic Name: 4-[(Z)-2-(2,2-dimethyl-1,3-benzodithiol-5-yl)prop-1-enyl]benzoic acid Openeye Name: 4-[(Z)-2-(2,2-dimethyl-1,3-benzodithiol-5-yl)prop-1-enyl]benzoic acid CAS Name: 4-[(Z)-2-(2,2-dimethyl-1,3-benzodithiol-5-yl)prop-1-enyl]benzoic acid IUPAC Name: 4-[(Z)-2-(2,2-dimethyl-1,3-benzodithiol-5-yl)prop-1-enyl]benzoic acid Traditional Name: 4-[(Z)-2-(2,2-dimethyl-1,3-benzodithiol-5-yl)prop-1-enyl]benzoic acid Formula: C19H18O2S2 MolecularWeight: 342.47502

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=C(C=C1)C(=O)O)C2=CC3=C(C=C2)SC(S3)(C)C

Isomeric SMILES

C/C(=C/C1=CC=C(C=C1)C(=O)O)/C2=CC3=C(C=C2)SC(S3)(C)C

InChI

InChI=1S/C19H18O2S2/c1-12(10-13-4-6-14(7-5-13)18(20)21)15-8-9-16-17(11-15)23-19(2,3)22-16/h4-11H,1-3H3,(H,20,21)/b12-10-