(E)-3-[3-(3-oxidanylpropyl)-4-(1-phenylethoxy)phenyl]but-2-enamide

Systemtic Name: (E)-3-[3-(3-oxidanylpropyl)-4-(1-phenylethoxy)phenyl]but-2-enamide Openeye Name: (E)-3-[3-(3-hydroxypropyl)-4-(1-phenylethoxy)phenyl]but-2-enamide CAS Name: (E)-3-[3-(3-hydroxypropyl)-4-(1-phenylethoxy)phenyl]-2-butenamide IUPAC Name: (E)-3-[3-(3-hydroxypropyl)-4-(1-phenylethoxy)phenyl]but-2-enamide Traditional Name: (E)-3-[3-(3-hydroxypropyl)-4-(1-phenylethoxy)phenyl]but-2-enamide Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC2=C(C=C(C=C2)C(=CC(=O)N)C)CCCO

Isomeric SMILES

CC(C1=CC=CC=C1)OC2=C(C=C(C=C2)/C(=C/C(=O)N)/C)CCCO

InChI

InChI=1S/C21H25NO3/c1-15(13-21(22)24)18-10-11-20(19(14-18)9-6-12-23)25-16(2)17-7-4-3-5-8-17/h3-5,7-8,10-11,13-14,16,23H,6,9,12H2,1-2H3,(H2,22,24)/b15-13+