(E)-3-[4-methoxy-3-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[4-methoxy-3-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one Openeye Name: (E)-3-[4-methoxy-3-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one CAS Name: (E)-3-[4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl]-1-[3-(1-pyrrolyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-[4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl]-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one Traditional Name: (E)-3-[4-methoxy-3-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one Formula: C28H24N2O5 MolecularWeight: 468.50056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=C(C=CC(=C2)C=CC(=O)C3=CC(=CC=C3)N4C=CC=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=C(C=CC(=C2)/C=C/C(=O)C3=CC(=CC=C3)N4C=CC=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C28H24N2O5/c1-20-16-25(10-11-26(20)30(32)33)35-19-23-17-21(9-13-28(23)34-2)8-12-27(31)22-6-5-7-24(18-22)29-14-3-4-15-29/h3-18H,19H2,1-2H3/b12-8+