(E)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-(4-ethoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-(4-ethoxyphenyl)prop-2-en-1-one Openeye Name: (E)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-(4-ethoxyphenyl)prop-2-en-1-one CAS Name: (E)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-(4-ethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-(4-ethoxyphenyl)prop-2-en-1-one Traditional Name: (E)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-p-phenetyl-prop-2-en-1-one Formula: C28H27NO4 MolecularWeight: 441.51828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)C(=CC2=CC=C(C=C2)OCC)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)/C(=C/C2=CC=C(C=C2)OCC)/C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C28H27NO4/c1-3-5-18-32-23-16-12-21(13-17-23)27(30)24(19-20-10-14-22(15-11-20)31-4-2)28-29-25-8-6-7-9-26(25)33-28/h6-17,19H,3-5,18H2,1-2H3/b24-19-