(3S)-3-butyl-3-methyl-2,4-dihydroisoquinolin-1-one

Systemtic Name: (3S)-3-butyl-3-methyl-2,4-dihydroisoquinolin-1-one Openeye Name: (3S)-3-butyl-3-methyl-2,4-dihydroisoquinolin-1-one CAS Name: (3S)-3-butyl-3-methyl-2,4-dihydroisoquinolin-1-one IUPAC Name: (3S)-3-butyl-3-methyl-2,4-dihydroisoquinolin-1-one Traditional Name: (3S)-3-butyl-3-methyl-2,4-dihydroisoquinolin-1-one Formula: C14H19NO MolecularWeight: 217.30676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CC2=CC=CC=C2C(=O)N1)C

Isomeric SMILES

CCCC[C@]1(CC2=CC=CC=C2C(=O)N1)C

InChI

InChI=1S/C14H19NO/c1-3-4-9-14(2)10-11-7-5-6-8-12(11)13(16)15-14/h5-8H,3-4,9-10H2,1-2H3,(H,15,16)/t14-/m0/s1