ethyl (E)-2-cyclohepta-1,3,5-trien-1-ylcarbonyl-3-(4-nitrophenyl)prop-2-enoate

Systemtic Name: ethyl (E)-2-cyclohepta-1,3,5-trien-1-ylcarbonyl-3-(4-nitrophenyl)prop-2-enoate Openeye Name: ethyl (E)-2-(cyclohepta-1,3,5-triene-1-carbonyl)-3-(4-nitrophenyl)prop-2-enoate CAS Name: (E)-2-[1-cyclohepta-1,3,5-trienyl(oxo)methyl]-3-(4-nitrophenyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-(cyclohepta-1,3,5-triene-1-carbonyl)-3-(4-nitrophenyl)prop-2-enoate Traditional Name: (E)-2-(cyclohepta-1,3,5-triene-1-carbonyl)-3-(4-nitrophenyl)acrylic acid ethyl ester Formula: C19H17NO5 MolecularWeight: 339.34198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=CC=CC2

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC=C(C=C1)[N+](=O)[O-])/C(=O)C2=CC=CC=CC2

InChI

InChI=1S/C19H17NO5/c1-2-25-19(22)17(18(21)15-7-5-3-4-6-8-15)13-14-9-11-16(12-10-14)20(23)24/h3-7,9-13H,2,8H2,1H3/b17-13+