(E)-3-(8-tert-butyl-2-chloranyl-quinolin-3-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(8-tert-butyl-2-chloranyl-quinolin-3-yl)prop-2-enoic acid Openeye Name: (E)-3-(8-tert-butyl-2-chloro-3-quinolyl)prop-2-enoic acid CAS Name: (E)-3-(8-tert-butyl-2-chloro-3-quinolinyl)-2-propenoic acid IUPAC Name: (E)-3-(8-tert-butyl-2-chloroquinolin-3-yl)prop-2-enoic acid Traditional Name: (E)-3-(8-tert-butyl-2-chloro-3-quinolyl)acrylic acid Formula: C16H16ClNO2 MolecularWeight: 289.75674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC2=CC(=C(N=C21)Cl)C=CC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=CC2=CC(=C(N=C21)Cl)/C=C/C(=O)O

InChI

InChI=1S/C16H16ClNO2/c1-16(2,3)12-6-4-5-10-9-11(7-8-13(19)20)15(17)18-14(10)12/h4-9H,1-3H3,(H,19,20)/b8-7+