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4-butyl-N-[(5-phenylisoquinolin-8-yl)methyl]benzamide

4-butyl-N-[(5-phenylisoquinolin-8-yl)methyl]benzamide

Systemtic Name:4-butyl-N-[(5-phenylisoquinolin-8-yl)methyl]benzamide
Openeye Name:4-butyl-N-[(5-phenyl-8-isoquinolyl)methyl]benzamide
CAS Name:4-butyl-N-[(5-phenyl-8-isoquinolinyl)methyl]benzamide
IUPAC Name:4-butyl-N-[(5-phenylisoquinolin-8-yl)methyl]benzamide
Traditional Name:4-butyl-N-[(5-phenyl-8-isoquinolyl)methyl]benzamide
Formula: C27H26N2O
MolecularWeight: 394.50814
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NCC2=C3C=NC=CC3=C(C=C2)C4=CC=CC=C4


Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NCC2=C3C=NC=CC3=C(C=C2)C4=CC=CC=C4


InChI

InChI=1S/C27H26N2O/c1-2-3-7-20-10-12-22(13-11-20)27(30)29-18-23-14-15-24(21-8-5-4-6-9-21)25-16-17-28-19-26(23)25/h4-6,8-17,19H,2-3,7,18H2,1H3,(H,29,30)


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