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

Systemtic Name: (1Z,4E)-1-(tert-butylamino)-1-(4-chlorophenyl)-5-oxidanyl-5-phenoxy-penta-1,4-dien-3-one Openeye Name: (1Z,4E)-1-(tert-butylamino)-1-(4-chlorophenyl)-5-hydroxy-5-phenoxy-penta-1,4-dien-3-one CAS Name: (1Z,4E)-1-(tert-butylamino)-1-(4-chlorophenyl)-5-hydroxy-5-phenoxy-3-penta-1,4-dienone IUPAC Name: (1Z,4E)-1-(tert-butylamino)-1-(4-chlorophenyl)-5-hydroxy-5-phenoxypenta-1,4-dien-3-one Traditional Name: (1Z,4E)-1-(tert-butylamino)-1-(4-chlorophenyl)-5-hydroxy-5-phenoxy-penta-1,4-dien-3-one Formula: C21H22ClNO3 MolecularWeight: 371.85728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=CC(=O)C=C(O)OC1=CC=CC=C1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)N/C(=C\C(=O)/C=C(\O)/OC1=CC=CC=C1)/C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H22ClNO3/c1-21(2,3)23-19(15-9-11-16(22)12-10-15)13-17(24)14-20(25)26-18-7-5-4-6-8-18/h4-14,23,25H,1-3H3/b19-13-,20-14+