1-[(3,4-dimethoxyphenyl)carbonylamino]-3-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]urea

Systemtic Name: 1-[(3,4-dimethoxyphenyl)carbonylamino]-3-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]urea Openeye Name: 1-[(3,4-dimethoxybenzoyl)amino]-3-[(2-morpholinopyridin-1-ium-3-yl)methyl]urea CAS Name: 1-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-3-[[2-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]urea IUPAC Name: 1-[(3,4-dimethoxybenzoyl)amino]-3-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]urea Traditional Name: 1-[(2-morpholinopyridin-1-ium-3-yl)methyl]-3-(veratroylamino)urea Formula: C20H26N5O5+ MolecularWeight: 416.45094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=O)NCC2=C([NH+]=CC=C2)N3CCOCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=O)NCC2=C([NH+]=CC=C2)N3CCOCC3)OC

InChI

InChI=1S/C20H25N5O5/c1-28-16-6-5-14(12-17(16)29-2)19(26)23-24-20(27)22-13-15-4-3-7-21-18(15)25-8-10-30-11-9-25/h3-7,12H,8-11,13H2,1-2H3,(H,23,26)(H2,22,24,27)/p+1