dicyclohexylazanium; (E)-2-methyl-3-phenyl-3-sulfanylidene-prop-1-en-1-olate

Systemtic Name: dicyclohexylazanium; (E)-2-methyl-3-phenyl-3-sulfanylidene-prop-1-en-1-olate Openeye Name: dicyclohexylammonium; (E)-2-methyl-3-phenyl-3-thioxo-prop-1-en-1-olate CAS Name: dicyclohexylammonium; (E)-2-methyl-3-phenyl-3-sulfanylidene-1-propen-1-olate IUPAC Name: dicyclohexylazanium; (E)-2-methyl-3-phenyl-3-sulfanylideneprop-1-en-1-olate Traditional Name: dicyclohexylammonium; (E)-2-methyl-3-phenyl-3-thioxo-prop-1-en-1-olate Formula: C22H33NOS MolecularWeight: 359.56852

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C[O-])C(=S)C1=CC=CC=C1.C1CCC(CC1)[NH2+]C2CCCCC2

Isomeric SMILES

C/C(=C\[O-])/C(=S)C1=CC=CC=C1.C1CCC(CC1)[NH2+]C2CCCCC2

InChI

InChI=1S/C12H23N.C10H10OS/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-8(7-11)10(12)9-5-3-2-4-6-9/h11-13H,1-10H2;2-7,11H,1H3/b;8-7+