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

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2-methylpropanoylamino)-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2-methylpropanoylamino)-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2-methyl-1-oxopropyl)amino]-N-(2-oxolanylmethyl)benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2-methylpropanoylamino)-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(isobutyrylamino)-N-(tetrahydrofurfuryl)benzamide Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NCC4CCCO4

Isomeric SMILES

CC(C)C(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NCC4CCCO4

InChI

InChI=1S/C25H31N3O3/c1-17(2)24(29)27-20-9-10-23(28-12-11-18-6-3-4-7-19(18)16-28)22(14-20)25(30)26-15-21-8-5-13-31-21/h3-4,6-7,9-10,14,17,21H,5,8,11-13,15-16H2,1-2H3,(H,26,30)(H,27,29)