3-methyl-N-[(2-nitrophenyl)methyl]-1,1-bis(oxidanylidene)thiolan-3-amine

Systemtic Name: 3-methyl-N-[(2-nitrophenyl)methyl]-1,1-bis(oxidanylidene)thiolan-3-amine Openeye Name: 3-methyl-N-[(2-nitrophenyl)methyl]-1,1-dioxo-thiolan-3-amine CAS Name: 3-methyl-N-[(2-nitrophenyl)methyl]-1,1-dioxo-3-thiolanamine IUPAC Name: 3-methyl-N-[(2-nitrophenyl)methyl]-1,1-dioxothiolan-3-amine Traditional Name: (1,1-diketo-3-methyl-thiolan-3-yl)-(2-nitrobenzyl)amine Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)NCC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1(CCS(=O)(=O)C1)NCC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O4S/c1-12(6-7-19(17,18)9-12)13-8-10-4-2-3-5-11(10)14(15)16/h2-5,13H,6-9H2,1H3