2-(1-adamantyl)-N-[4-chloranyl-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[4-chloranyl-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide CAS Name: 2-(1-adamantyl)-N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide Formula: C26H27ClN2O2 MolecularWeight: 434.95778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)C3=C(C=CC(=C3)NC(=O)CC45CC6CC(C4)CC(C6)C5)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)C3=C(C=CC(=C3)NC(=O)CC45CC6CC(C4)CC(C6)C5)Cl

InChI

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