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

Systemtic Name: 1-(4-ethoxyphenyl)-3-[4-(piperidin-1-ium-1-ylmethyl)phenyl]urea Openeye Name: 1-(4-ethoxyphenyl)-3-[4-(piperidin-1-ium-1-ylmethyl)phenyl]urea CAS Name: 1-(4-ethoxyphenyl)-3-[4-(1-piperidin-1-iumylmethyl)phenyl]urea IUPAC Name: 1-(4-ethoxyphenyl)-3-[4-(piperidin-1-ium-1-ylmethyl)phenyl]urea Traditional Name: 1-[4-(piperidin-1-ium-1-ylmethyl)phenyl]-3-p-phenetyl-urea Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C21H27N3O2/c1-2-26-20-12-10-19(11-13-20)23-21(25)22-18-8-6-17(7-9-18)16-24-14-4-3-5-15-24/h6-13H,2-5,14-16H2,1H3,(H2,22,23,25)/p+1