[2-(3-bromanyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)-2-oxidanylidene-ethyl] piperidine-1-carbodithioate

Systemtic Name: [2-(3-bromanyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)-2-oxidanylidene-ethyl] piperidine-1-carbodithioate Openeye Name: [2-(3-bromo-7-hydroxy-4-methyl-2-oxo-chromen-8-yl)-2-oxo-ethyl] piperidine-1-carbodithioate CAS Name: 1-piperidinecarbodithioic acid [2-(3-bromo-7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromo-7-hydroxy-4-methyl-2-oxochromen-8-yl)-2-oxoethyl] piperidine-1-carbodithioate Traditional Name: piperidine-1-carbodithioic acid [2-(3-bromo-7-hydroxy-2-keto-4-methyl-chromen-8-yl)-2-keto-ethyl] ester Formula: C18H18BrNO4S2 MolecularWeight: 456.37382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C(=O)CSC(=S)N3CCCCC3)O)Br

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C(=O)CSC(=S)N3CCCCC3)O)Br

InChI

InChI=1S/C18H18BrNO4S2/c1-10-11-5-6-12(21)14(16(11)24-17(23)15(10)19)13(22)9-26-18(25)20-7-3-2-4-8-20/h5-6,21H,2-4,7-9H2,1H3