ethyl N-(3-methoxyphenyl)carbonyl-N'-(2-pyrrolidin-1-ium-1-ylethyl)carbamimidate

Systemtic Name: ethyl N-(3-methoxyphenyl)carbonyl-N'-(2-pyrrolidin-1-ium-1-ylethyl)carbamimidate Openeye Name: N-[C-ethoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)carbonimidoyl]-3-methoxy-benzamide CAS Name: N-[(3-methoxyphenyl)-oxomethyl]-N'-[2-(1-pyrrolidin-1-iumyl)ethyl]carbamimidic acid ethyl ester IUPAC Name: ethyl N-(3-methoxybenzoyl)-N'-(2-pyrrolidin-1-ium-1-ylethyl)carbamimidate Traditional Name: N-[C-ethoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)carbonimidoyl]-3-methoxy-benzamide Formula: C17H26N3O3+ MolecularWeight: 320.40664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=NCC[NH+]1CCCC1)NC(=O)C2=CC(=CC=C2)OC

Isomeric SMILES

CCOC(=NCC[NH+]1CCCC1)NC(=O)C2=CC(=CC=C2)OC

InChI

InChI=1S/C17H25N3O3/c1-3-23-17(18-9-12-20-10-4-5-11-20)19-16(21)14-7-6-8-15(13-14)22-2/h6-8,13H,3-5,9-12H2,1-2H3,(H,18,19,21)/p+1