(6Z)-2-(1-adamantyl)-4-methoxy-6-[[(phenylmethyl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-2-(1-adamantyl)-4-methoxy-6-[[(phenylmethyl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-2-(1-adamantyl)-6-[(benzylamino)methylene]-4-methoxy-cyclohexa-2,4-dien-1-one CAS Name: (6Z)-2-(1-adamantyl)-4-methoxy-6-[[(phenylmethyl)amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-2-(1-adamantyl)-6-[(benzylamino)methylidene]-4-methoxycyclohexa-2,4-dien-1-one Traditional Name: (6Z)-2-(1-adamantyl)-6-[(benzylamino)methylene]-4-methoxy-cyclohexa-2,4-dien-1-one Formula: C25H29NO2 MolecularWeight: 375.50326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNCC2=CC=CC=C2)C(=O)C(=C1)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=C/C(=C/NCC2=CC=CC=C2)/C(=O)C(=C1)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H29NO2/c1-28-22-10-21(16-26-15-17-5-3-2-4-6-17)24(27)23(11-22)25-12-18-7-19(13-25)9-20(8-18)14-25/h2-6,10-11,16,18-20,26H,7-9,12-15H2,1H3/b21-16-