1-[(4-butylphenyl)methyl]isoquinoline

Systemtic Name: 1-[(4-butylphenyl)methyl]isoquinoline Openeye Name: 1-[(4-butylphenyl)methyl]isoquinoline CAS Name: 1-[(4-butylphenyl)methyl]isoquinoline IUPAC Name: 1-[(4-butylphenyl)methyl]isoquinoline Traditional Name: 1-(4-butylbenzyl)isoquinoline Formula: C20H21N MolecularWeight: 275.38744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC2=NC=CC3=CC=CC=C32

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C20H21N/c1-2-3-6-16-9-11-17(12-10-16)15-20-19-8-5-4-7-18(19)13-14-21-20/h4-5,7-14H,2-3,6,15H2,1H3