2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)-5-[[(E)-3-phenylprop-2-enoyl]amino]benzamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)-5-[[(E)-3-phenylprop-2-enoyl]amino]benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[[(E)-3-phenylprop-2-enoyl]amino]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-oxolanylmethyl)-5-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)-5-[[(E)-3-phenylprop-2-enoyl]amino]benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[[(E)-3-phenylacryloyl]amino]-N-(tetrahydrofurfuryl)benzamide Formula: C30H31N3O3 MolecularWeight: 481.58544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H31N3O3/c34-29(15-12-22-7-2-1-3-8-22)32-25-13-14-28(33-17-16-23-9-4-5-10-24(23)21-33)27(19-25)30(35)31-20-26-11-6-18-36-26/h1-5,7-10,12-15,19,26H,6,11,16-18,20-21H2,(H,31,35)(H,32,34)/b15-12+