2-[4-(4-cyano-1-phenyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazin-1-yl]-N-(2-methoxyethyl)-2-oxidanylidene-ethanamide

Systemtic Name: 2-[4-(4-cyano-1-phenyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazin-1-yl]-N-(2-methoxyethyl)-2-oxidanylidene-ethanamide Openeye Name: 2-[4-(4-cyano-1-phenyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazin-1-yl]-N-(2-methoxyethyl)-2-oxo-acetamide CAS Name: 2-[4-(4-cyano-1-phenyl-5,6,7,8-tetrahydroisoquinolin-3-yl)-1-piperazinyl]-N-(2-methoxyethyl)-2-oxoacetamide IUPAC Name: 2-[4-(4-cyano-1-phenyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide Traditional Name: 2-[4-(4-cyano-1-phenyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazino]-2-keto-N-(2-methoxyethyl)acetamide Formula: C25H29N5O3 MolecularWeight: 447.52946

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C(=O)N1CCN(CC1)C2=NC(=C3CCCCC3=C2C#N)C4=CC=CC=C4

Isomeric SMILES

COCCNC(=O)C(=O)N1CCN(CC1)C2=NC(=C3CCCCC3=C2C#N)C4=CC=CC=C4

InChI

InChI=1S/C25H29N5O3/c1-33-16-11-27-24(31)25(32)30-14-12-29(13-15-30)23-21(17-26)19-9-5-6-10-20(19)22(28-23)18-7-3-2-4-8-18/h2-4,7-8H,5-6,9-16H2,1H3,(H,27,31)