3-(aminocarbonylamino)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3-(aminocarbonylamino)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-3-ureido-benzamide CAS Name: 3-(carbamoylamino)-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-(carbamoylamino)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]-3-ureido-benzamide Formula: C21H27N4O2+ MolecularWeight: 367.46468

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)C3=CC(=CC=C3)NC(=O)N

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)C3=CC(=CC=C3)NC(=O)N

InChI

InChI=1S/C21H26N4O2/c22-21(27)24-19-10-6-9-16(13-19)20(26)23-14-17-7-2-3-8-18(17)15-25-11-4-1-5-12-25/h2-3,6-10,13H,1,4-5,11-12,14-15H2,(H,23,26)(H3,22,24,27)/p+1