4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanoyl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanoyl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxoethyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]-N-phenyl-piperazine-1-carboxamide Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC(=O)N3CCN(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC(=O)N3CCN(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H26N4O2/c27-21(17-24-11-10-18-6-4-5-7-19(18)16-24)25-12-14-26(15-13-25)22(28)23-20-8-2-1-3-9-20/h1-9H,10-17H2,(H,23,28)