N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-N-prop-2-enyl-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-N-prop-2-enyl-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-allyl-N-[4-(4-nitrophenyl)thiazol-2-yl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[4-(4-nitrophenyl)-2-thiazolyl]-N-prop-2-enyl-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-N-prop-2-enyl-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-allyl-N-[4-(4-nitrophenyl)thiazol-2-yl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C18H21N4O3S+ MolecularWeight: 373.44934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=NC(=CS1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C[NH+]3CCCC3

Isomeric SMILES

C=CCN(C1=NC(=CS1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C[NH+]3CCCC3

InChI

InChI=1S/C18H20N4O3S/c1-2-9-21(17(23)12-20-10-3-4-11-20)18-19-16(13-26-18)14-5-7-15(8-6-14)22(24)25/h2,5-8,13H,1,3-4,9-12H2/p+1