2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)-5-[(4-pentylphenyl)carbonylamino]benzamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)-5-[(4-pentylphenyl)carbonylamino]benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-pentylbenzoyl)amino]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-oxolanylmethyl)-5-[[oxo-(4-pentylphenyl)methyl]amino]benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(oxolan-2-ylmethyl)-5-[(4-pentylbenzoyl)amino]benzamide Traditional Name: 5-[(4-amylbenzoyl)amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(tetrahydrofurfuryl)benzamide Formula: C33H39N3O3 MolecularWeight: 525.68106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NCC5CCCO5

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)C(=O)NCC5CCCO5

InChI

InChI=1S/C33H39N3O3/c1-2-3-4-8-24-12-14-26(15-13-24)32(37)35-28-16-17-31(36-19-18-25-9-5-6-10-27(25)23-36)30(21-28)33(38)34-22-29-11-7-20-39-29/h5-6,9-10,12-17,21,29H,2-4,7-8,11,18-20,22-23H2,1H3,(H,34,38)(H,35,37)