(2R)-N-cyclohexyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: (2R)-N-cyclohexyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: (2R)-N-cyclohexyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: (2R)-N-cyclohexyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: (2R)-N-cyclohexyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: (2R)-N-cyclohexyl-2-(6-nitro-1,3-benzodioxol-5-yl)-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C19H26N3O5+ MolecularWeight: 376.42684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC3=C(C=C2[N+](=O)[O-])OCO3)[NH+]4CCCC4

Isomeric SMILES

C1CCC(CC1)NC(=O)[C@@H](C2=CC3=C(C=C2[N+](=O)[O-])OCO3)[NH+]4CCCC4

InChI

InChI=1S/C19H25N3O5/c23-19(20-13-6-2-1-3-7-13)18(21-8-4-5-9-21)14-10-16-17(27-12-26-16)11-15(14)22(24)25/h10-11,13,18H,1-9,12H2,(H,20,23)/p+1/t18-/m1/s1