(1S,5S)-5-(1,3-benzodioxol-5-yl)-N,N-dimethyl-6-nitro-cyclohex-2-en-1-amine

Systemtic Name: (1S,5S)-5-(1,3-benzodioxol-5-yl)-N,N-dimethyl-6-nitro-cyclohex-2-en-1-amine Openeye Name: (1S,5S)-5-(1,3-benzodioxol-5-yl)-N,N-dimethyl-6-nitro-cyclohex-2-en-1-amine CAS Name: (1S,5S)-5-(1,3-benzodioxol-5-yl)-N,N-dimethyl-6-nitro-1-cyclohex-2-enamine IUPAC Name: (1S,5S)-5-(1,3-benzodioxol-5-yl)-N,N-dimethyl-6-nitrocyclohex-2-en-1-amine Traditional Name: [(1S,5S)-5-(1,3-benzodioxol-5-yl)-6-nitro-cyclohex-2-en-1-yl]-dimethyl-amine Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1C=CCC(C1[N+](=O)[O-])C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN(C)[C@H]1C=CC[C@H](C1[N+](=O)[O-])C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H18N2O4/c1-16(2)12-5-3-4-11(15(12)17(18)19)10-6-7-13-14(8-10)21-9-20-13/h3,5-8,11-12,15H,4,9H2,1-2H3/t11-,12-,15?/m0/s1