(2E)-1-(1-adamantyl)-2-[7-(hydroxymethyl)-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene]ethanone

Systemtic Name: (2E)-1-(1-adamantyl)-2-[7-(hydroxymethyl)-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene]ethanone Openeye Name: (2E)-1-(1-adamantyl)-2-[7-(hydroxymethyl)-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene]ethanone CAS Name: (2E)-1-(1-adamantyl)-2-[7-(hydroxymethyl)-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene]ethanone IUPAC Name: (2E)-1-(1-adamantyl)-2-[7-(hydroxymethyl)-2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene]ethanone Traditional Name: (2E)-1-(1-adamantyl)-2-(2,2-dimethyl-7-methylol-3H-1,3-benzoxazin-4-ylidene)ethanone Formula: C23H29NO3 MolecularWeight: 367.48126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29NO3/c1-22(2)24-19(18-4-3-14(13-25)8-20(18)27-22)9-21(26)23-10-15-5-16(11-23)7-17(6-15)12-23/h3-4,8-9,15-17,24-25H,5-7,10-13H2,1-2H3/b19-9+