N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2-phenylmethoxyethanoylamino)benzamide

Systemtic Name: N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2-phenylmethoxyethanoylamino)benzamide Openeye Name: 5-[(2-benzyloxyacetyl)amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(1-oxo-2-phenylmethoxyethyl)amino]benzamide IUPAC Name: N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2-phenylmethoxyacetyl)amino]benzamide Traditional Name: 5-[(2-benzoxyacetyl)amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-sec-butyl-benzamide Formula: C29H33N3O3 MolecularWeight: 471.59062

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)COCC2=CC=CC=C2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)COCC2=CC=CC=C2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C29H33N3O3/c1-3-21(2)30-29(34)26-17-25(31-28(33)20-35-19-22-9-5-4-6-10-22)13-14-27(26)32-16-15-23-11-7-8-12-24(23)18-32/h4-14,17,21H,3,15-16,18-20H2,1-2H3,(H,30,34)(H,31,33)