3-[4-(2,2-dimethylpentanoyl)phenyl]-1-methyl-1-[4-(methylamino)cyclohexyl]urea

Systemtic Name: 3-[4-(2,2-dimethylpentanoyl)phenyl]-1-methyl-1-[4-(methylamino)cyclohexyl]urea Openeye Name: 3-[4-(2,2-dimethylpentanoyl)phenyl]-1-methyl-1-[4-(methylamino)cyclohexyl]urea CAS Name: 3-[4-(2,2-dimethyl-1-oxopentyl)phenyl]-1-methyl-1-[4-(methylamino)cyclohexyl]urea IUPAC Name: 3-[4-(2,2-dimethylpentanoyl)phenyl]-1-methyl-1-[4-(methylamino)cyclohexyl]urea Traditional Name: 3-[4-(2,2-dimethylpentanoyl)phenyl]-1-methyl-1-[4-(methylamino)cyclohexyl]urea Formula: C22H35N3O2 MolecularWeight: 373.5322

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)C(=O)C1=CC=C(C=C1)NC(=O)N(C)C2CCC(CC2)NC

Isomeric SMILES

CCCC(C)(C)C(=O)C1=CC=C(C=C1)NC(=O)N(C)C2CCC(CC2)NC

InChI

InChI=1S/C22H35N3O2/c1-6-15-22(2,3)20(26)16-7-9-18(10-8-16)24-21(27)25(5)19-13-11-17(23-4)12-14-19/h7-10,17,19,23H,6,11-15H2,1-5H3,(H,24,27)