6-[(1-adamantylamino)methylidene]-4-bromanyl-2-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[(1-adamantylamino)methylidene]-4-bromanyl-2-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[(1-adamantylamino)methylene]-4-bromo-2-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[(1-adamantylamino)methylidene]-4-bromo-2-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(1-adamantylamino)methylidene]-4-bromo-2-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[(1-adamantylamino)methylene]-4-bromo-2-methoxy-cyclohexa-2,4-dien-1-one Formula: C18H22BrNO2 MolecularWeight: 364.27678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=CNC23CC4CC(C2)CC(C4)C3)C1=O)Br

Isomeric SMILES

COC1=CC(=CC(=CNC23CC4CC(C2)CC(C4)C3)C1=O)Br

InChI

InChI=1S/C18H22BrNO2/c1-22-16-6-15(19)5-14(17(16)21)10-20-18-7-11-2-12(8-18)4-13(3-11)9-18/h5-6,10-13,20H,2-4,7-9H2,1H3