1-(2-oxidanylidene-2-phenylazanyl-ethyl)-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-(2-oxidanylidene-2-phenylazanyl-ethyl)-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carboxamide Openeye Name: 1-(2-anilino-2-oxo-ethyl)-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carboxamide CAS Name: 1-(2-anilino-2-oxoethyl)-4-(1-piperidin-1-iumyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-(2-anilino-2-oxoethyl)-4-piperidin-1-ium-1-ylpiperidin-1-ium-4-carboxamide Traditional Name: 1-(2-anilino-2-keto-ethyl)-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carboxamide Formula: C19H30N4O2+2 MolecularWeight: 346.4671

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2(CC[NH+](CC2)CC(=O)NC3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1CC[NH+](CC1)C2(CC[NH+](CC2)CC(=O)NC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C19H28N4O2/c20-18(25)19(23-11-5-2-6-12-23)9-13-22(14-10-19)15-17(24)21-16-7-3-1-4-8-16/h1,3-4,7-8H,2,5-6,9-15H2,(H2,20,25)(H,21,24)/p+2