(2Z)-1-(1-adamantyl)-2-(6-chloranyl-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene)ethanone

Systemtic Name: (2Z)-1-(1-adamantyl)-2-(6-chloranyl-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene)ethanone Openeye Name: (2Z)-1-(1-adamantyl)-2-(6-chloro-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene)ethanone CAS Name: (2Z)-1-(1-adamantyl)-2-(6-chloro-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene)ethanone IUPAC Name: (2Z)-1-(1-adamantyl)-2-(6-chloro-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene)ethanone Traditional Name: (2Z)-1-(1-adamantyl)-2-(6-chloro-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene)ethanone Formula: C22H26ClNO2 MolecularWeight: 371.90034

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Descriptors Computed from Structure

Canonical SMILES:

CC1(NC(=CC(=O)C23CC4CC(C2)CC(C4)C3)C5=C(O1)C=CC(=C5)Cl)C

Isomeric SMILES

CC1(N/C(=C\C(=O)C23CC4CC(C2)CC(C4)C3)/C5=C(O1)C=CC(=C5)Cl)C

InChI

InChI=1S/C22H26ClNO2/c1-21(2)24-18(17-8-16(23)3-4-19(17)26-21)9-20(25)22-10-13-5-14(11-22)7-15(6-13)12-22/h3-4,8-9,13-15,24H,5-7,10-12H2,1-2H3/b18-9-