3-propan-2-yl-2-prop-2-ynyl-isoquinolin-1-one

Systemtic Name: 3-propan-2-yl-2-prop-2-ynyl-isoquinolin-1-one Openeye Name: 3-isopropyl-2-prop-2-ynyl-isoquinolin-1-one CAS Name: 3-propan-2-yl-2-prop-2-ynyl-1-isoquinolinone IUPAC Name: 3-propan-2-yl-2-prop-2-ynylisoquinolin-1-one Traditional Name: 3-isopropyl-2-propargyl-isocarbostyril Formula: C15H15NO MolecularWeight: 225.2857

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=CC=CC=C2C(=O)N1CC#C

Isomeric SMILES

CC(C)C1=CC2=CC=CC=C2C(=O)N1CC#C

InChI

InChI=1S/C15H15NO/c1-4-9-16-14(11(2)3)10-12-7-5-6-8-13(12)15(16)17/h1,5-8,10-11H,9H2,2-3H3