(3R)-1-(3-ethylphenyl)-N-(1-ethylpiperidin-1-ium-4-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3R)-1-(3-ethylphenyl)-N-(1-ethylpiperidin-1-ium-4-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3R)-1-(3-ethylphenyl)-N-(1-ethylpiperidin-1-ium-4-yl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3R)-1-(3-ethylphenyl)-N-(1-ethyl-4-piperidin-1-iumyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3R)-1-(3-ethylphenyl)-N-(1-ethylpiperidin-1-ium-4-yl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3R)-1-(3-ethylphenyl)-N-(1-ethylpiperidin-1-ium-4-yl)-5-keto-pyrrolidine-3-carboxamide Formula: C20H30N3O2+ MolecularWeight: 344.4711

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)N2CC(CC2=O)C(=O)NC3CC[NH+](CC3)CC

Isomeric SMILES

CCC1=CC(=CC=C1)N2C[C@@H](CC2=O)C(=O)NC3CC[NH+](CC3)CC

InChI

InChI=1S/C20H29N3O2/c1-3-15-6-5-7-18(12-15)23-14-16(13-19(23)24)20(25)21-17-8-10-22(4-2)11-9-17/h5-7,12,16-17H,3-4,8-11,13-14H2,1-2H3,(H,21,25)/p+1/t16-/m1/s1