2-(1-adamantyl)-N-[2-(3-chloranyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[2-(3-chloranyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[2-(3-chloro-4-methyl-phenyl)-1,3-benzoxazol-5-yl]acetamide CAS Name: 2-(1-adamantyl)-N-[2-(3-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[2-(3-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]acetamide Traditional Name: 2-(1-adamantyl)-N-[2-(3-chloro-4-methyl-phenyl)-1,3-benzoxazol-5-yl]acetamide Formula: C26H27ClN2O2 MolecularWeight: 434.95778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)CC45CC6CC(C4)CC(C6)C5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)CC45CC6CC(C4)CC(C6)C5)Cl

InChI

InChI=1S/C26H27ClN2O2/c1-15-2-3-19(9-21(15)27)25-29-22-10-20(4-5-23(22)31-25)28-24(30)14-26-11-16-6-17(12-26)8-18(7-16)13-26/h2-5,9-10,16-18H,6-8,11-14H2,1H3,(H,28,30)