(1-naphthalen-1-yl-2-nitro-ethyl) N,N-diethylcarbamodithioate

Systemtic Name: (1-naphthalen-1-yl-2-nitro-ethyl) N,N-diethylcarbamodithioate Openeye Name: [1-(1-naphthyl)-2-nitro-ethyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [1-(1-naphthalenyl)-2-nitroethyl] ester IUPAC Name: (1-naphthalen-1-yl-2-nitroethyl) N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [1-(1-naphthyl)-2-nitro-ethyl] ester Formula: C17H20N2O2S2 MolecularWeight: 348.4829

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SC(C[N+](=O)[O-])C1=CC=CC2=CC=CC=C21

Isomeric SMILES

CCN(CC)C(=S)SC(C[N+](=O)[O-])C1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C17H20N2O2S2/c1-3-18(4-2)17(22)23-16(12-19(20)21)15-11-7-9-13-8-5-6-10-14(13)15/h5-11,16H,3-4,12H2,1-2H3