1-[2-oxidanylidene-2-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-oxidanylidene-2-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-oxo-2-[4-(2-oxopyrrolidin-1-yl)anilino]ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-oxo-2-[4-(2-oxo-1-pyrrolidinyl)anilino]ethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-oxo-2-[4-(2-oxopyrrolidin-1-yl)anilino]ethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-[4-(2-ketopyrrolidino)anilino]ethyl]piperidin-1-ium-4-carboxamide Formula: C18H25N4O3+ MolecularWeight: 345.4161

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C18H24N4O3/c19-18(25)13-7-10-21(11-8-13)12-16(23)20-14-3-5-15(6-4-14)22-9-1-2-17(22)24/h3-6,13H,1-2,7-12H2,(H2,19,25)(H,20,23)/p+1