4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-N-(2-phenylmethoxyethyl)benzamide

Systemtic Name: 4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-N-(2-phenylmethoxyethyl)benzamide Openeye Name: N-(2-benzyloxyethyl)-4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]benzamide CAS Name: 4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]-N-(2-phenylmethoxyethyl)benzamide IUPAC Name: 4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-N-(2-phenylmethoxyethyl)benzamide Traditional Name: N-(2-benzoxyethyl)-4-[1-(4-ethylpiperazino)-3-isoquinolyl]benzamide Formula: C31H34N4O2 MolecularWeight: 494.62726

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(=O)NCCOCC5=CC=CC=C5

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(=O)NCCOCC5=CC=CC=C5

InChI

InChI=1S/C31H34N4O2/c1-2-34-17-19-35(20-18-34)30-28-11-7-6-10-27(28)22-29(33-30)25-12-14-26(15-13-25)31(36)32-16-21-37-23-24-8-4-3-5-9-24/h3-15,22H,2,16-21,23H2,1H3,(H,32,36)