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

Systemtic Name: (E)-3-[4-methoxy-3-(phenoxymethyl)phenyl]-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one Openeye Name: (E)-3-[4-methoxy-3-(phenoxymethyl)phenyl]-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one CAS Name: (E)-3-[4-methoxy-3-(phenoxymethyl)phenyl]-1-[3-(1-pyrrolyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-[4-methoxy-3-(phenoxymethyl)phenyl]-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one Traditional Name: (E)-3-[4-methoxy-3-(phenoxymethyl)phenyl]-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one Formula: C27H23NO3 MolecularWeight: 409.47642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC(=CC=C2)N3C=CC=C3)COC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC(=CC=C2)N3C=CC=C3)COC4=CC=CC=C4

InChI

InChI=1S/C27H23NO3/c1-30-27-15-13-21(18-23(27)20-31-25-10-3-2-4-11-25)12-14-26(29)22-8-7-9-24(19-22)28-16-5-6-17-28/h2-19H,20H2,1H3/b14-12+