(3R)-1-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylphenyl)amino]ethyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylphenyl)amino]ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[2-oxo-2-[4-(1-pyrrolidinyl)anilino]ethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[2-keto-2-(4-pyrrolidinoanilino)ethyl]piperidin-1-ium-3-carboxamide Formula: C18H27N4O2+ MolecularWeight: 331.43258

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCCC(C3)C(=O)N

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCC[C@H](C3)C(=O)N

InChI

InChI=1S/C18H26N4O2/c19-18(24)14-4-3-9-21(12-14)13-17(23)20-15-5-7-16(8-6-15)22-10-1-2-11-22/h5-8,14H,1-4,9-13H2,(H2,19,24)(H,20,23)/p+1/t14-/m1/s1