(E)-1-(4-hydroxyphenyl)-3-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-hydroxyphenyl)-3-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]prop-2-en-1-one Openeye Name: (E)-1-(4-hydroxyphenyl)-3-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]prop-2-en-1-one CAS Name: (E)-1-(4-hydroxyphenyl)-3-[4-methoxy-3-[(4-nitro-1-pyrazolyl)methyl]phenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-hydroxyphenyl)-3-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]prop-2-en-1-one Traditional Name: (E)-1-(4-hydroxyphenyl)-3-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]prop-2-en-1-one Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)O)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)O)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O5/c1-28-20-9-3-14(2-8-19(25)15-4-6-18(24)7-5-15)10-16(20)12-22-13-17(11-21-22)23(26)27/h2-11,13,24H,12H2,1H3/b8-2+