nonyl N-[(4-nitrophenyl)carbonylamino]carbamodithioate

Systemtic Name: nonyl N-[(4-nitrophenyl)carbonylamino]carbamodithioate Openeye Name: nonyl N-[(4-nitrobenzoyl)amino]carbamodithioate CAS Name: N-[[(4-nitrophenyl)-oxomethyl]amino]carbamodithioic acid nonyl ester IUPAC Name: nonyl N-[(4-nitrobenzoyl)amino]carbamodithioate Traditional Name: N-[(4-nitrobenzoyl)amino]carbamodithioic acid nonyl ester Formula: C17H25N3O3S2 MolecularWeight: 383.5287

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCSC(=S)NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCSC(=S)NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O3S2/c1-2-3-4-5-6-7-8-13-25-17(24)19-18-16(21)14-9-11-15(12-10-14)20(22)23/h9-12H,2-8,13H2,1H3,(H,18,21)(H,19,24)