(E)-1-(4-methylphenyl)-3-[5-[(2-nitrophenoxy)methyl]furan-2-yl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-methylphenyl)-3-[5-[(2-nitrophenoxy)methyl]furan-2-yl]prop-2-en-1-one Openeye Name: (E)-3-[5-[(2-nitrophenoxy)methyl]-2-furyl]-1-(p-tolyl)prop-2-en-1-one CAS Name: (E)-1-(4-methylphenyl)-3-[5-[(2-nitrophenoxy)methyl]-2-furanyl]-2-propen-1-one IUPAC Name: (E)-1-(4-methylphenyl)-3-[5-[(2-nitrophenoxy)methyl]furan-2-yl]prop-2-en-1-one Traditional Name: (E)-3-[5-[(2-nitrophenoxy)methyl]-2-furyl]-1-(p-tolyl)prop-2-en-1-one Formula: C21H17NO5 MolecularWeight: 363.36338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=CC2=CC=C(O2)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(O2)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H17NO5/c1-15-6-8-16(9-7-15)20(23)13-12-17-10-11-18(27-17)14-26-21-5-3-2-4-19(21)22(24)25/h2-13H,14H2,1H3/b13-12+