2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2,2-dimethylpropanoylamino)-N-(3-morpholin-4-ylpropyl)benzamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2,2-dimethylpropanoylamino)-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2,2-dimethylpropanoylamino)-N-(3-morpholinopropyl)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2,2-dimethyl-1-oxopropyl)amino]-N-[3-(4-morpholinyl)propyl]benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2,2-dimethylpropanoylamino)-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholinopropyl)-5-(pivaloylamino)benzamide Formula: C28H38N4O3 MolecularWeight: 478.62632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NCCCN4CCOCC4

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NCCCN4CCOCC4

InChI

InChI=1S/C28H38N4O3/c1-28(2,3)27(34)30-23-9-10-25(32-14-11-21-7-4-5-8-22(21)20-32)24(19-23)26(33)29-12-6-13-31-15-17-35-18-16-31/h4-5,7-10,19H,6,11-18,20H2,1-3H3,(H,29,33)(H,30,34)