N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: N-[5-(5-ethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-3-(3-nitrophenyl)acrylamide Formula: C25H21N3O4 MolecularWeight: 427.45194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)C)NC(=O)C=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)C)NC(=O)C=CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H21N3O4/c1-3-17-8-11-23-22(14-17)27-25(32-23)19-10-7-16(2)21(15-19)26-24(29)12-9-18-5-4-6-20(13-18)28(30)31/h4-15H,3H2,1-2H3,(H,26,29)