2-[(4-cyclohexylphenyl)methyl]-3-ethoxy-3-oxidanylidene-propanethioic S-acid

Systemtic Name: 2-[(4-cyclohexylphenyl)methyl]-3-ethoxy-3-oxidanylidene-propanethioic S-acid Openeye Name: 2-[(4-cyclohexylphenyl)methyl]-3-ethoxy-3-oxo-propanethioic S-acid CAS Name: 2-[(4-cyclohexylphenyl)methyl]-3-ethoxy-3-oxopropanethioic S-acid IUPAC Name: 2-[(4-cyclohexylphenyl)methyl]-3-ethoxy-3-oxopropanethioic S-acid Traditional Name: 2-(4-cyclohexylbenzyl)-3-ethoxy-3-keto-thiopropionic acid Formula: C18H24O3S MolecularWeight: 320.44636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)C2CCCCC2)C(=O)S

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)C2CCCCC2)C(=O)S

InChI

InChI=1S/C18H24O3S/c1-2-21-17(19)16(18(20)22)12-13-8-10-15(11-9-13)14-6-4-3-5-7-14/h8-11,14,16H,2-7,12H2,1H3,(H,20,22)