4-[(E)-hex-4-enyl]-3-methyl-isoquinoline

Systemtic Name: 4-[(E)-hex-4-enyl]-3-methyl-isoquinoline Openeye Name: 4-[(E)-hex-4-enyl]-3-methyl-isoquinoline CAS Name: 4-[(E)-hex-4-enyl]-3-methylisoquinoline IUPAC Name: 4-[(E)-hex-4-enyl]-3-methylisoquinoline Traditional Name: 4-[(E)-hex-4-enyl]-3-methyl-isoquinoline Formula: C16H19N MolecularWeight: 225.32876

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCCCC1=C(N=CC2=CC=CC=C21)C

Isomeric SMILES

C/C=C/CCCC1=C(N=CC2=CC=CC=C21)C

InChI

InChI=1S/C16H19N/c1-3-4-5-6-10-15-13(2)17-12-14-9-7-8-11-16(14)15/h3-4,7-9,11-12H,5-6,10H2,1-2H3/b4-3+