propyl 2-[4-(3,4-dihydro-2H-thiochromen-4-yl)phenoxy]-2-phenyl-ethanoate

Systemtic Name: propyl 2-[4-(3,4-dihydro-2H-thiochromen-4-yl)phenoxy]-2-phenyl-ethanoate Openeye Name: propyl 2-phenyl-2-(4-thiochroman-4-ylphenoxy)acetate CAS Name: 2-[4-(3,4-dihydro-2H-1-benzothiopyran-4-yl)phenoxy]-2-phenylacetic acid propyl ester IUPAC Name: propyl 2-[4-(3,4-dihydro-2H-thiochromen-4-yl)phenoxy]-2-phenylacetate Traditional Name: 2-phenyl-2-(4-thiochroman-4-ylphenoxy)acetic acid propyl ester Formula: C26H26O3S MolecularWeight: 418.54784

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(C1=CC=CC=C1)OC2=CC=C(C=C2)C3CCSC4=CC=CC=C34

Isomeric SMILES

CCCOC(=O)C(C1=CC=CC=C1)OC2=CC=C(C=C2)C3CCSC4=CC=CC=C34

InChI

InChI=1S/C26H26O3S/c1-2-17-28-26(27)25(20-8-4-3-5-9-20)29-21-14-12-19(13-15-21)22-16-18-30-24-11-7-6-10-23(22)24/h3-15,22,25H,2,16-18H2,1H3