(E)-3-[4-[(1-adamantylamino)methyl]phenyl]-N-(2-aminophenyl)prop-2-enamide

Systemtic Name: (E)-3-[4-[(1-adamantylamino)methyl]phenyl]-N-(2-aminophenyl)prop-2-enamide Openeye Name: (E)-3-[4-[(1-adamantylamino)methyl]phenyl]-N-(2-aminophenyl)prop-2-enamide CAS Name: (E)-3-[4-[(1-adamantylamino)methyl]phenyl]-N-(2-aminophenyl)-2-propenamide IUPAC Name: (E)-3-[4-[(1-adamantylamino)methyl]phenyl]-N-(2-aminophenyl)prop-2-enamide Traditional Name: (E)-3-[4-[(1-adamantylamino)methyl]phenyl]-N-(2-aminophenyl)acrylamide Formula: C26H31N3O MolecularWeight: 401.54384

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NCC4=CC=C(C=C4)C=CC(=O)NC5=CC=CC=C5N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NCC4=CC=C(C=C4)/C=C/C(=O)NC5=CC=CC=C5N

InChI

InChI=1S/C26H31N3O/c27-23-3-1-2-4-24(23)29-25(30)10-9-18-5-7-19(8-6-18)17-28-26-14-20-11-21(15-26)13-22(12-20)16-26/h1-10,20-22,28H,11-17,27H2,(H,29,30)/b10-9+