S-[10a,12a-dimethyl-2,8-bis(oxidanylidene)-4,4a,4b,5,6,9,10,10b,11,12-decahydro-3H-naphtho[2,1-f]chromen-10-yl] ethanethioate

Systemtic Name: S-[10a,12a-dimethyl-2,8-bis(oxidanylidene)-4,4a,4b,5,6,9,10,10b,11,12-decahydro-3H-naphtho[2,1-f]chromen-10-yl] ethanethioate Openeye Name: S-(10a,12a-dimethyl-2,8-dioxo-4,4a,4b,5,6,9,10,10b,11,12-decahydro-3H-naphtho[2,1-f]chromen-10-yl) ethanethioate CAS Name: ethanethioic acid S-(10a,12a-dimethyl-2,8-dioxo-4,4a,4b,5,6,9,10,10b,11,12-decahydro-3H-naphtho[2,1-f][1]benzopyran-10-yl) ester IUPAC Name: S-(10a,12a-dimethyl-2,8-dioxo-4,4a,4b,5,6,9,10,10b,11,12-decahydro-3H-naphtho[2,1-f]chromen-10-yl) ethanethioate Traditional Name: ethanethioic acid S-(2,8-diketo-10a,12a-dimethyl-4,4a,4b,5,6,9,10,10b,11,12-decahydro-3H-naphtho[2,1-f]chromen-10-yl) ester Formula: C21H28O4S MolecularWeight: 376.50962

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CC(=O)C=C2C1(C3CCC4(C(C3CC2)CCC(=O)O4)C)C

Isomeric SMILES

CC(=O)SC1CC(=O)C=C2C1(C3CCC4(C(C3CC2)CCC(=O)O4)C)C

InChI

InChI=1S/C21H28O4S/c1-12(22)26-18-11-14(23)10-13-4-5-15-16-6-7-19(24)25-20(16,2)9-8-17(15)21(13,18)3/h10,15-18H,4-9,11H2,1-3H3