3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanoylamino]-N,N-diethyl-benzamide Openeye Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-N,N-diethyl-benzamide Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CN2CCC3=CC=CC=C3C2

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CN2CCC3=CC=CC=C3C2

InChI

InChI=1S/C22H27N3O2/c1-3-25(4-2)22(27)18-10-7-11-20(14-18)23-21(26)16-24-13-12-17-8-5-6-9-19(17)15-24/h5-11,14H,3-4,12-13,15-16H2,1-2H3,(H,23,26)