1-[[1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-3-phenyl-urea

Systemtic Name: 1-[[1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-3-phenyl-urea Openeye Name: 1-[[1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-3-phenyl-urea CAS Name: 1-[[1-[(3-chlorophenyl)methyl]-4-piperidin-1-iumyl]methyl]-3-phenylurea IUPAC Name: 1-[[1-[(3-chlorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-3-phenylurea Traditional Name: 1-[[1-(3-chlorobenzyl)piperidin-1-ium-4-yl]methyl]-3-phenyl-urea Formula: C20H25ClN3O+ MolecularWeight: 358.885

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CNC(=O)NC2=CC=CC=C2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1C[NH+](CCC1CNC(=O)NC2=CC=CC=C2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H24ClN3O/c21-18-6-4-5-17(13-18)15-24-11-9-16(10-12-24)14-22-20(25)23-19-7-2-1-3-8-19/h1-8,13,16H,9-12,14-15H2,(H2,22,23,25)/p+1