(E)-3-(1-butyl-2-oxidanylidene-pyridin-4-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(1-butyl-2-oxidanylidene-pyridin-4-yl)prop-2-enoic acid Openeye Name: (E)-3-(1-butyl-2-oxo-4-pyridyl)prop-2-enoic acid CAS Name: (E)-3-(1-butyl-2-oxo-4-pyridinyl)-2-propenoic acid IUPAC Name: (E)-3-(1-butyl-2-oxopyridin-4-yl)prop-2-enoic acid Traditional Name: (E)-3-(1-butyl-2-keto-4-pyridyl)acrylic acid Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=CC(=CC1=O)C=CC(=O)O

Isomeric SMILES

CCCCN1C=CC(=CC1=O)/C=C/C(=O)O

InChI

InChI=1S/C12H15NO3/c1-2-3-7-13-8-6-10(9-11(13)14)4-5-12(15)16/h4-6,8-9H,2-3,7H2,1H3,(H,15,16)/b5-4+