1-(16-isoquinolin-1-ylhexadecyl)isoquinoline

Systemtic Name: 1-(16-isoquinolin-1-ylhexadecyl)isoquinoline Openeye Name: 1-[16-(1-isoquinolyl)hexadecyl]isoquinoline CAS Name: 1-[16-(1-isoquinolinyl)hexadecyl]isoquinoline IUPAC Name: 1-(16-isoquinolin-1-ylhexadecyl)isoquinoline Traditional Name: 1-[16-(1-isoquinolyl)hexadecyl]isoquinoline Formula: C34H44N2 MolecularWeight: 480.72656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN=C2CCCCCCCCCCCCCCCCC3=NC=CC4=CC=CC=C43

Isomeric SMILES

C1=CC=C2C(=C1)C=CN=C2CCCCCCCCCCCCCCCCC3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C34H44N2/c1(3-5-7-9-11-13-23-33-31-21-17-15-19-29(31)25-27-35-33)2-4-6-8-10-12-14-24-34-32-22-18-16-20-30(32)26-28-36-34/h15-22,25-28H,1-14,23-24H2