1-(2-methoxyphenyl)-3-[4-(piperidin-1-ium-1-ylmethyl)phenyl]urea

Systemtic Name: 1-(2-methoxyphenyl)-3-[4-(piperidin-1-ium-1-ylmethyl)phenyl]urea Openeye Name: 1-(2-methoxyphenyl)-3-[4-(piperidin-1-ium-1-ylmethyl)phenyl]urea CAS Name: 1-(2-methoxyphenyl)-3-[4-(1-piperidin-1-iumylmethyl)phenyl]urea IUPAC Name: 1-(2-methoxyphenyl)-3-[4-(piperidin-1-ium-1-ylmethyl)phenyl]urea Traditional Name: 1-(2-methoxyphenyl)-3-[4-(piperidin-1-ium-1-ylmethyl)phenyl]urea Formula: C20H26N3O2+ MolecularWeight: 340.43934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

COC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C20H25N3O2/c1-25-19-8-4-3-7-18(19)22-20(24)21-17-11-9-16(10-12-17)15-23-13-5-2-6-14-23/h3-4,7-12H,2,5-6,13-15H2,1H3,(H2,21,22,24)/p+1