tert-butyl (E)-3-(6-butyl-3-methanoyl-pyridin-2-yl)prop-2-enoate

Systemtic Name: tert-butyl (E)-3-(6-butyl-3-methanoyl-pyridin-2-yl)prop-2-enoate Openeye Name: tert-butyl (E)-3-(6-butyl-3-formyl-2-pyridyl)prop-2-enoate CAS Name: (E)-3-(6-butyl-3-formyl-2-pyridinyl)-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-3-(6-butyl-3-formylpyridin-2-yl)prop-2-enoate Traditional Name: (E)-3-(6-butyl-3-formyl-2-pyridyl)acrylic acid tert-butyl ester Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C=C1)C=O)C=CC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=NC(=C(C=C1)C=O)/C=C/C(=O)OC(C)(C)C

InChI

InChI=1S/C17H23NO3/c1-5-6-7-14-9-8-13(12-19)15(18-14)10-11-16(20)21-17(2,3)4/h8-12H,5-7H2,1-4H3/b11-10+