1-[(2,3-dimethoxyphenyl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)-3-phenyl-urea

Systemtic Name: 1-[(2,3-dimethoxyphenyl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)-3-phenyl-urea Openeye Name: 1-[(2,3-dimethoxyphenyl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)-3-phenyl-urea CAS Name: 1-[(2,3-dimethoxyphenyl)methyl]-1-[3-(4-morpholin-4-iumyl)propyl]-3-phenylurea IUPAC Name: 1-[(2,3-dimethoxyphenyl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)-3-phenylurea Traditional Name: 1-(3-morpholin-4-ium-4-ylpropyl)-1-o-veratryl-3-phenyl-urea Formula: C23H32N3O4+ MolecularWeight: 414.51788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN(CCC[NH+]2CCOCC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1OC)CN(CCC[NH+]2CCOCC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O4/c1-28-21-11-6-8-19(22(21)29-2)18-26(13-7-12-25-14-16-30-17-15-25)23(27)24-20-9-4-3-5-10-20/h3-6,8-11H,7,12-18H2,1-2H3,(H,24,27)/p+1