(1Z,4E)-1-(tert-butylamino)-1-(4-methylphenyl)-5-oxidanyl-5-phenoxy-penta-1,4-dien-3-one

Systemtic Name: (1Z,4E)-1-(tert-butylamino)-1-(4-methylphenyl)-5-oxidanyl-5-phenoxy-penta-1,4-dien-3-one Openeye Name: (1Z,4E)-1-(tert-butylamino)-5-hydroxy-5-phenoxy-1-(p-tolyl)penta-1,4-dien-3-one CAS Name: (1Z,4E)-1-(tert-butylamino)-5-hydroxy-1-(4-methylphenyl)-5-phenoxy-3-penta-1,4-dienone IUPAC Name: (1Z,4E)-1-(tert-butylamino)-5-hydroxy-1-(4-methylphenyl)-5-phenoxypenta-1,4-dien-3-one Traditional Name: (1Z,4E)-1-(tert-butylamino)-5-hydroxy-5-phenoxy-1-(p-tolyl)penta-1,4-dien-3-one Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=CC(=O)C=C(O)OC2=CC=CC=C2)NC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)/C(=C/C(=O)/C=C(\O)/OC2=CC=CC=C2)/NC(C)(C)C

InChI

InChI=1S/C22H25NO3/c1-16-10-12-17(13-11-16)20(23-22(2,3)4)14-18(24)15-21(25)26-19-8-6-5-7-9-19/h5-15,23,25H,1-4H3/b20-14-,21-15+