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

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-ethoxypropyl)-5-(2-methylpropanoylamino)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-ethoxypropyl)-5-(2-methylpropanoylamino)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-ethoxypropyl)-5-[(2-methyl-1-oxopropyl)amino]benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-ethoxypropyl)-5-(2-methylpropanoylamino)benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-ethoxypropyl)-5-(isobutyrylamino)benzamide Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)C(C)C)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)C(C)C)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C25H33N3O3/c1-4-31-15-7-13-26-25(30)22-16-21(27-24(29)18(2)3)10-11-23(22)28-14-12-19-8-5-6-9-20(19)17-28/h5-6,8-11,16,18H,4,7,12-15,17H2,1-3H3,(H,26,30)(H,27,29)