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

Systemtic Name: (E)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-(2-methoxyphenyl)prop-2-en-1-one Openeye Name: (E)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-(2-methoxyphenyl)prop-2-en-1-one CAS Name: (E)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-(2-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-(2-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-(2-methoxyphenyl)prop-2-en-1-one Formula: C27H25NO4 MolecularWeight: 427.4917

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)C(=CC2=CC=CC=C2OC)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)/C(=C/C2=CC=CC=C2OC)/C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C27H25NO4/c1-3-4-17-31-21-15-13-19(14-16-21)26(29)22(18-20-9-5-7-11-24(20)30-2)27-28-23-10-6-8-12-25(23)32-27/h5-16,18H,3-4,17H2,1-2H3/b22-18-