3-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]carbonylamino]-4-piperidin-1-yl-benzamide

Systemtic Name: 3-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]carbonylamino]-4-piperidin-1-yl-benzamide Openeye Name: 3-[[4-(piperidin-1-ium-1-ylmethyl)benzoyl]amino]-4-(1-piperidyl)benzamide CAS Name: 3-[[oxo-[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]amino]-4-(1-piperidinyl)benzamide IUPAC Name: 3-[[4-(piperidin-1-ium-1-ylmethyl)benzoyl]amino]-4-piperidin-1-ylbenzamide Traditional Name: 3-[[4-(piperidin-1-ium-1-ylmethyl)benzoyl]amino]-4-piperidino-benzamide Formula: C25H33N4O2+ MolecularWeight: 421.55512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(=O)N)N4CCCCC4

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(=O)N)N4CCCCC4

InChI

InChI=1S/C25H32N4O2/c26-24(30)21-11-12-23(29-15-5-2-6-16-29)22(17-21)27-25(31)20-9-7-19(8-10-20)18-28-13-3-1-4-14-28/h7-12,17H,1-6,13-16,18H2,(H2,26,30)(H,27,31)/p+1