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

Systemtic Name: 3-[4-(2,2-dimethylpentanoyl)phenyl]-1-(1-ethylpiperidin-4-yl)-1-methyl-urea Openeye Name: 3-[4-(2,2-dimethylpentanoyl)phenyl]-1-(1-ethyl-4-piperidyl)-1-methyl-urea CAS Name: 3-[4-(2,2-dimethyl-1-oxopentyl)phenyl]-1-(1-ethyl-4-piperidinyl)-1-methylurea IUPAC Name: 3-[4-(2,2-dimethylpentanoyl)phenyl]-1-(1-ethylpiperidin-4-yl)-1-methylurea Traditional Name: 3-[4-(2,2-dimethylpentanoyl)phenyl]-1-(1-ethyl-4-piperidyl)-1-methyl-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)C2CCN(CC2)CC

Isomeric SMILES

CCCC(C)(C)C(=O)C1=CC=C(C=C1)NC(=O)N(C)C2CCN(CC2)CC

InChI

InChI=1S/C22H35N3O2/c1-6-14-22(3,4)20(26)17-8-10-18(11-9-17)23-21(27)24(5)19-12-15-25(7-2)16-13-19/h8-11,19H,6-7,12-16H2,1-5H3,(H,23,27)