methyl 4-[(5-methanoyl-3-methoxy-2-oxidanyl-phenyl)methyl]piperazine-1-carbodithioate

Systemtic Name: methyl 4-[(5-methanoyl-3-methoxy-2-oxidanyl-phenyl)methyl]piperazine-1-carbodithioate Openeye Name: methyl 4-[(5-formyl-2-hydroxy-3-methoxy-phenyl)methyl]piperazine-1-carbodithioate CAS Name: 4-[(5-formyl-2-hydroxy-3-methoxyphenyl)methyl]-1-piperazinecarbodithioic acid methyl ester IUPAC Name: methyl 4-[(5-formyl-2-hydroxy-3-methoxyphenyl)methyl]piperazine-1-carbodithioate Traditional Name: 4-(5-formyl-2-hydroxy-3-methoxy-benzyl)piperazine-1-carbodithioic acid methyl ester Formula: C15H20N2O3S2 MolecularWeight: 340.4609

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)CN2CCN(CC2)C(=S)SC)C=O

Isomeric SMILES

COC1=CC(=CC(=C1O)CN2CCN(CC2)C(=S)SC)C=O

InChI

InChI=1S/C15H20N2O3S2/c1-20-13-8-11(10-18)7-12(14(13)19)9-16-3-5-17(6-4-16)15(21)22-2/h7-8,10,19H,3-6,9H2,1-2H3