1-(5-chloranyl-2-methoxy-phenyl)-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]urea

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]urea Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-(5-chloro-2-methoxy-phenyl)urea CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-[1-(phenylmethyl)-4-piperidin-1-iumyl]urea IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-(5-chloro-2-methoxyphenyl)urea Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-(5-chloro-2-methoxy-phenyl)urea Formula: C20H25ClN3O2+ MolecularWeight: 374.8844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H24ClN3O2/c1-26-19-8-7-16(21)13-18(19)23-20(25)22-17-9-11-24(12-10-17)14-15-5-3-2-4-6-15/h2-8,13,17H,9-12,14H2,1H3,(H2,22,23,25)/p+1