4-azanyl-2-(3,4-dimethoxyphenyl)-5-ethyl-1-methoxy-2-methyl-3-oxidanylidene-4-propyl-pyrrolidin-1-ium-1-carboxylic acid

Systemtic Name: 4-azanyl-2-(3,4-dimethoxyphenyl)-5-ethyl-1-methoxy-2-methyl-3-oxidanylidene-4-propyl-pyrrolidin-1-ium-1-carboxylic acid Openeye Name: 4-amino-2-(3,4-dimethoxyphenyl)-5-ethyl-1-methoxy-2-methyl-3-oxo-4-propyl-pyrrolidin-1-ium-1-carboxylic acid CAS Name: 4-amino-2-(3,4-dimethoxyphenyl)-5-ethyl-1-methoxy-2-methyl-3-oxo-4-propyl-1-pyrrolidin-1-iumcarboxylic acid IUPAC Name: 4-amino-2-(3,4-dimethoxyphenyl)-5-ethyl-1-methoxy-2-methyl-3-oxo-4-propylpyrrolidin-1-ium-1-carboxylic acid Traditional Name: 4-amino-2-(3,4-dimethoxyphenyl)-5-ethyl-3-keto-1-methoxy-2-methyl-4-propyl-pyrrolidin-1-ium-1-carboxylic acid Formula: C20H31N2O6+ MolecularWeight: 395.46994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C([N+](C(C1=O)(C)C2=CC(=C(C=C2)OC)OC)(C(=O)O)OC)CC)N

Isomeric SMILES

CCCC1(C([N+](C(C1=O)(C)C2=CC(=C(C=C2)OC)OC)(C(=O)O)OC)CC)N

InChI

InChI=1S/C20H30N2O6/c1-7-11-20(21)16(8-2)22(28-6,18(24)25)19(3,17(20)23)13-9-10-14(26-4)15(12-13)27-5/h9-10,12,16H,7-8,11,21H2,1-6H3/p+1