N-[2-(cyclohexen-1-yl)ethyl]-6-nitro-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-6-nitro-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-6-nitro-1,1-dioxo-1,2-benzothiazol-3-amine CAS Name: N-[2-(1-cyclohexenyl)ethyl]-6-nitro-1,1-dioxo-1,2-benzothiazol-3-amine IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-6-nitro-1,1-dioxo-1,2-benzothiazol-3-amine Traditional Name: 2-(cyclohexen-1-yl)ethyl-(1,1-diketo-6-nitro-1,2-benzothiazol-3-yl)amine Formula: C15H17N3O4S MolecularWeight: 335.37818

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC2=NS(=O)(=O)C3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(=CC1)CCNC2=NS(=O)(=O)C3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O4S/c19-18(20)12-6-7-13-14(10-12)23(21,22)17-15(13)16-9-8-11-4-2-1-3-5-11/h4,6-7,10H,1-3,5,8-9H2,(H,16,17)