4-butoxy-N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide

Systemtic Name: 4-butoxy-N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Openeye Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-butoxy-benzamide CAS Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-butoxybenzamide IUPAC Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-butoxybenzamide Traditional Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-butoxy-benzamide Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC=C4)C=C2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C27H28N2O3/c1-2-3-17-32-25-13-10-21(11-14-25)26(30)28-24-12-9-20-15-16-29(19-23(20)18-24)27(31)22-7-5-4-6-8-22/h4-14,18H,2-3,15-17,19H2,1H3,(H,28,30)