1-[[4-(3-methoxyprop-1-ynyl)phenyl]methyl]isoquinoline

Systemtic Name: 1-[[4-(3-methoxyprop-1-ynyl)phenyl]methyl]isoquinoline Openeye Name: 1-[[4-(3-methoxyprop-1-ynyl)phenyl]methyl]isoquinoline CAS Name: 1-[[4-(3-methoxyprop-1-ynyl)phenyl]methyl]isoquinoline IUPAC Name: 1-[[4-(3-methoxyprop-1-ynyl)phenyl]methyl]isoquinoline Traditional Name: 1-[4-(3-methoxyprop-1-ynyl)benzyl]isoquinoline Formula: C20H17NO MolecularWeight: 287.35508

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Descriptors Computed from Structure

Canonical SMILES:

COCC#CC1=CC=C(C=C1)CC2=NC=CC3=CC=CC=C32

Isomeric SMILES

COCC#CC1=CC=C(C=C1)CC2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C20H17NO/c1-22-14-4-5-16-8-10-17(11-9-16)15-20-19-7-3-2-6-18(19)12-13-21-20/h2-3,6-13H,14-15H2,1H3