N-(3-chloranyl-2,6-diethyl-phenyl)-4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazine-1-carboxamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazine-1-carboxamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-4-[(3-methylisoxazol-5-yl)methyl]piperazine-1-carboxamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-4-[(3-methyl-5-isoxazolyl)methyl]-1-piperazinecarboxamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazine-1-carboxamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-4-[(3-methylisoxazol-5-yl)methyl]piperazine-1-carboxamide Formula: C20H27ClN4O2 MolecularWeight: 390.90698

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)N2CCN(CC2)CC3=CC(=NO3)C

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)N2CCN(CC2)CC3=CC(=NO3)C

InChI

InChI=1S/C20H27ClN4O2/c1-4-15-6-7-18(21)17(5-2)19(15)22-20(26)25-10-8-24(9-11-25)13-16-12-14(3)23-27-16/h6-7,12H,4-5,8-11,13H2,1-3H3,(H,22,26)