[6-bromanyl-2-(2-nitrophenyl)-4-oxidanylidene-2,3-dihydrochromen-3-yl] N,N-dimethylcarbamodithioate

Systemtic Name: [6-bromanyl-2-(2-nitrophenyl)-4-oxidanylidene-2,3-dihydrochromen-3-yl] N,N-dimethylcarbamodithioate Openeye Name: [6-bromo-2-(2-nitrophenyl)-4-oxo-chroman-3-yl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [6-bromo-2-(2-nitrophenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [6-bromo-2-(2-nitrophenyl)-4-oxo-2,3-dihydrochromen-3-yl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [6-bromo-4-keto-2-(2-nitrophenyl)chroman-3-yl] ester Formula: C18H15BrN2O4S2 MolecularWeight: 467.3567

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)SC1C(OC2=C(C1=O)C=C(C=C2)Br)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=S)SC1C(OC2=C(C1=O)C=C(C=C2)Br)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H15BrN2O4S2/c1-20(2)18(26)27-17-15(22)12-9-10(19)7-8-14(12)25-16(17)11-5-3-4-6-13(11)21(23)24/h3-9,16-17H,1-2H3