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

Systemtic Name: 3-[4-(2,2-dimethylpentanoyl)phenyl]-1-methyl-1-(4-oxidanylidenecyclohexyl)urea Openeye Name: 3-[4-(2,2-dimethylpentanoyl)phenyl]-1-methyl-1-(4-oxocyclohexyl)urea CAS Name: 3-[4-(2,2-dimethyl-1-oxopentyl)phenyl]-1-methyl-1-(4-oxocyclohexyl)urea IUPAC Name: 3-[4-(2,2-dimethylpentanoyl)phenyl]-1-methyl-1-(4-oxocyclohexyl)urea Traditional Name: 3-[4-(2,2-dimethylpentanoyl)phenyl]-1-(4-ketocyclohexyl)-1-methyl-urea Formula: C21H30N2O3 MolecularWeight: 358.4745

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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(=O)CC2

Isomeric SMILES

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

InChI

InChI=1S/C21H30N2O3/c1-5-14-21(2,3)19(25)15-6-8-16(9-7-15)22-20(26)23(4)17-10-12-18(24)13-11-17/h6-9,17H,5,10-14H2,1-4H3,(H,22,26)