(Z)-2-(tert-butylsulfanylmethyl)-3-naphthalen-1-yl-prop-2-enoic acid

Systemtic Name: (Z)-2-(tert-butylsulfanylmethyl)-3-naphthalen-1-yl-prop-2-enoic acid Openeye Name: (Z)-2-(tert-butylsulfanylmethyl)-3-(1-naphthyl)prop-2-enoic acid CAS Name: (Z)-2-[(tert-butylthio)methyl]-3-(1-naphthalenyl)-2-propenoic acid IUPAC Name: (Z)-2-(tert-butylsulfanylmethyl)-3-naphthalen-1-ylprop-2-enoic acid Traditional Name: (Z)-2-[(tert-butylthio)methyl]-3-(1-naphthyl)acrylic acid Formula: C18H20O2S MolecularWeight: 300.4152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(=CC1=CC=CC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CC(C)(C)SC/C(=C\C1=CC=CC2=CC=CC=C21)/C(=O)O

InChI

InChI=1S/C18H20O2S/c1-18(2,3)21-12-15(17(19)20)11-14-9-6-8-13-7-4-5-10-16(13)14/h4-11H,12H2,1-3H3,(H,19,20)/b15-11+