1-[[2-(dimethylaminomethyl)-3-oxidanylidene-3-(4-phenylmethoxyphenyl)propyl]amino]urea chloride

Systemtic Name: 1-[[2-(dimethylaminomethyl)-3-oxidanylidene-3-(4-phenylmethoxyphenyl)propyl]amino]urea chloride Openeye Name: [[3-(4-benzyloxyphenyl)-2-(dimethylaminomethyl)-3-oxo-propyl]amino]urea chloride CAS Name: [[2-(dimethylaminomethyl)-3-oxo-3-(4-phenylmethoxyphenyl)propyl]amino]urea chloride IUPAC Name: [[2-(dimethylaminomethyl)-3-oxo-3-(4-phenylmethoxyphenyl)propyl]amino]urea chloride Traditional Name: [[3-(4-benzoxyphenyl)-2-(dimethylaminomethyl)-3-keto-propyl]amino]urea chloride Formula: C20H26ClN4O3- MolecularWeight: 405.89844

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(CNNC(=O)N)C(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CN(C)CC(CNNC(=O)N)C(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C20H26N4O3.ClH/c1-24(2)13-17(12-22-23-20(21)26)19(25)16-8-10-18(11-9-16)27-14-15-6-4-3-5-7-15;/h3-11,17,22H,12-14H2,1-2H3,(H3,21,23,26);1H/p-1