4-[(Z)-2-(6-methoxy-4,4-dimethyl-2,3-dihydrothiochromen-7-yl)prop-1-enyl]benzoic acid

Systemtic Name: 4-[(Z)-2-(6-methoxy-4,4-dimethyl-2,3-dihydrothiochromen-7-yl)prop-1-enyl]benzoic acid Openeye Name: 4-[(Z)-2-(6-methoxy-4,4-dimethyl-thiochroman-7-yl)prop-1-enyl]benzoic acid CAS Name: 4-[(Z)-2-(6-methoxy-4,4-dimethyl-2,3-dihydro-1-benzothiopyran-7-yl)prop-1-enyl]benzoic acid IUPAC Name: 4-[(Z)-2-(6-methoxy-4,4-dimethyl-2,3-dihydrothiochromen-7-yl)prop-1-enyl]benzoic acid Traditional Name: 4-[(Z)-2-(6-methoxy-4,4-dimethyl-thiochroman-7-yl)prop-1-enyl]benzoic acid Formula: C22H24O3S MolecularWeight: 368.48916

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=C(C=C1)C(=O)O)C2=CC3=C(C=C2OC)C(CCS3)(C)C

Isomeric SMILES

C/C(=C/C1=CC=C(C=C1)C(=O)O)/C2=CC3=C(C=C2OC)C(CCS3)(C)C

InChI

InChI=1S/C22H24O3S/c1-14(11-15-5-7-16(8-6-15)21(23)24)17-12-20-18(13-19(17)25-4)22(2,3)9-10-26-20/h5-8,11-13H,9-10H2,1-4H3,(H,23,24)/b14-11-