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

Systemtic Name: (E)-3-[3-(chloromethyl)-4-methoxy-phenyl]-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one Openeye Name: (E)-3-[3-(chloromethyl)-4-methoxy-phenyl]-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one CAS Name: (E)-3-[3-(chloromethyl)-4-methoxyphenyl]-1-[3-(1-pyrrolyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-[3-(chloromethyl)-4-methoxyphenyl]-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one Traditional Name: (E)-3-[3-(chloromethyl)-4-methoxy-phenyl]-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one Formula: C21H18ClNO2 MolecularWeight: 351.82612

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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)CCl

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClNO2/c1-25-21-10-8-16(13-18(21)15-22)7-9-20(24)17-5-4-6-19(14-17)23-11-2-3-12-23/h2-14H,15H2,1H3/b9-7+