(3-ethanoyl-2,4,6-trimethyl-phenyl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: (3-ethanoyl-2,4,6-trimethyl-phenyl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate Openeye Name: (3-acetyl-2,4,6-trimethyl-phenyl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(3-nitrophenyl)-2-propenoic acid (3-acetyl-2,4,6-trimethylphenyl)methyl ester IUPAC Name: (3-acetyl-2,4,6-trimethylphenyl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(3-nitrophenyl)acrylic acid (3-acetyl-2,4,6-trimethyl-benzyl) ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C21H21NO5/c1-13-10-14(2)21(16(4)23)15(3)19(13)12-27-20(24)9-8-17-6-5-7-18(11-17)22(25)26/h5-11H,12H2,1-4H3/b9-8+