6-cyclopentyl-8-(4-phenoxyphenyl)isoquinolin-1-amine

Systemtic Name: 6-cyclopentyl-8-(4-phenoxyphenyl)isoquinolin-1-amine Openeye Name: 6-cyclopentyl-8-(4-phenoxyphenyl)isoquinolin-1-amine CAS Name: 6-cyclopentyl-8-(4-phenoxyphenyl)-1-isoquinolinamine IUPAC Name: 6-cyclopentyl-8-(4-phenoxyphenyl)isoquinolin-1-amine Traditional Name: [6-cyclopentyl-8-(4-phenoxyphenyl)-1-isoquinolyl]amine Formula: C26H24N2O MolecularWeight: 380.48156

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=CC(=C3C(=C2)C=CN=C3N)C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)C2=CC(=C3C(=C2)C=CN=C3N)C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

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