3-butyl-4-(2-methylprop-2-enyl)isoquinoline

Systemtic Name: 3-butyl-4-(2-methylprop-2-enyl)isoquinoline Openeye Name: 3-butyl-4-(2-methylallyl)isoquinoline CAS Name: 3-butyl-4-(2-methylprop-2-enyl)isoquinoline IUPAC Name: 3-butyl-4-(2-methylprop-2-enyl)isoquinoline Traditional Name: 3-butyl-4-(2-methylallyl)isoquinoline Formula: C17H21N MolecularWeight: 239.35534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2C=N1)CC(=C)C

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2C=N1)CC(=C)C

InChI

InChI=1S/C17H21N/c1-4-5-10-17-16(11-13(2)3)15-9-7-6-8-14(15)12-18-17/h6-9,12H,2,4-5,10-11H2,1,3H3