N-(3-cyclopentyloxy-4-methoxy-phenyl)isoquinolin-1-amine

Systemtic Name: N-(3-cyclopentyloxy-4-methoxy-phenyl)isoquinolin-1-amine Openeye Name: N-[3-(cyclopentoxy)-4-methoxy-phenyl]isoquinolin-1-amine CAS Name: N-(3-cyclopentyloxy-4-methoxyphenyl)-1-isoquinolinamine IUPAC Name: N-(3-cyclopentyloxy-4-methoxyphenyl)isoquinolin-1-amine Traditional Name: [3-(cyclopentoxy)-4-methoxy-phenyl]-(1-isoquinolyl)amine Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC=CC3=CC=CC=C32)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC=CC3=CC=CC=C32)OC4CCCC4

InChI

InChI=1S/C21H22N2O2/c1-24-19-11-10-16(14-20(19)25-17-7-3-4-8-17)23-21-18-9-5-2-6-15(18)12-13-22-21/h2,5-6,9-14,17H,3-4,7-8H2,1H3,(H,22,23)