2-ethynyl-1-methyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-ethynyl-1-methyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-ethynyl-1-methyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-ethynyl-1-methyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-ethynyl-1-methyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-ethynyl-1-methyl-3,4-dihydro-1H-isoquinoline Formula: C12H13N MolecularWeight: 171.23832

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CC=C2CCN1C#C

Isomeric SMILES

CC1C2=CC=CC=C2CCN1C#C

InChI

InChI=1S/C12H13N/c1-3-13-9-8-11-6-4-5-7-12(11)10(13)2/h1,4-7,10H,8-9H2,2H3