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

Systemtic Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-pentyl-urea Openeye Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-pentyl-urea CAS Name: 1-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-3-pentylurea IUPAC Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-pentylurea Traditional Name: 1-amyl-3-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]urea Formula: C18H29ClN3O+ MolecularWeight: 338.89536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)NC1CC[NH+](CC1)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCNC(=O)NC1CC[NH+](CC1)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H28ClN3O/c1-2-3-4-11-20-18(23)21-17-9-12-22(13-10-17)14-15-5-7-16(19)8-6-15/h5-8,17H,2-4,9-14H2,1H3,(H2,20,21,23)/p+1