5-cyclopentyl-7-(4-phenoxyphenyl)isoquinolin-1-amine

Systemtic Name: 5-cyclopentyl-7-(4-phenoxyphenyl)isoquinolin-1-amine Openeye Name: 5-cyclopentyl-7-(4-phenoxyphenyl)isoquinolin-1-amine CAS Name: 5-cyclopentyl-7-(4-phenoxyphenyl)-1-isoquinolinamine IUPAC Name: 5-cyclopentyl-7-(4-phenoxyphenyl)isoquinolin-1-amine Traditional Name: [5-cyclopentyl-7-(4-phenoxyphenyl)-1-isoquinolyl]amine Formula: C26H24N2O MolecularWeight: 380.48156

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=C3C=CN=C(C3=CC(=C2)C4=CC=C(C=C4)OC5=CC=CC=C5)N

Isomeric SMILES

C1CCC(C1)C2=C3C=CN=C(C3=CC(=C2)C4=CC=C(C=C4)OC5=CC=CC=C5)N

InChI

InChI=1S/C26H24N2O/c27-26-25-17-20(16-24(19-6-4-5-7-19)23(25)14-15-28-26)18-10-12-22(13-11-18)29-21-8-2-1-3-9-21/h1-3,8-17,19H,4-7H2,(H2,27,28)