2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)-5-(2-phenylethanoylamino)benzamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)-5-(2-phenylethanoylamino)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2-phenylacetyl)amino]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-oxolanylmethyl)-5-[(1-oxo-2-phenylethyl)amino]benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)-5-[(2-phenylacetyl)amino]benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2-phenylacetyl)amino]-N-(tetrahydrofurfuryl)benzamide Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=C(C=CC(=C2)NC(=O)CC3=CC=CC=C3)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=C(C=CC(=C2)NC(=O)CC3=CC=CC=C3)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C29H31N3O3/c33-28(17-21-7-2-1-3-8-21)31-24-12-13-27(32-15-14-22-9-4-5-10-23(22)20-32)26(18-24)29(34)30-19-25-11-6-16-35-25/h1-5,7-10,12-13,18,25H,6,11,14-17,19-20H2,(H,30,34)(H,31,33)