5-[(2-chloranyl-2-phenyl-ethanoyl)amino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide

Systemtic Name: 5-[(2-chloranyl-2-phenyl-ethanoyl)amino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Openeye Name: 5-[(2-chloro-2-phenyl-acetyl)amino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide CAS Name: 5-[(2-chloro-1-oxo-2-phenylethyl)amino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide IUPAC Name: 5-[(2-chloro-2-phenylacetyl)amino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Traditional Name: 5-[(2-chloro-2-phenyl-acetyl)amino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Formula: C27H26ClN3O2 MolecularWeight: 459.96724

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=C(C=CC(=C2)NC(=O)C(C3=CC=CC=C3)Cl)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CC1NC(=O)C2=C(C=CC(=C2)NC(=O)C(C3=CC=CC=C3)Cl)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C27H26ClN3O2/c28-25(19-7-2-1-3-8-19)27(33)30-22-12-13-24(23(16-22)26(32)29-21-10-11-21)31-15-14-18-6-4-5-9-20(18)17-31/h1-9,12-13,16,21,25H,10-11,14-15,17H2,(H,29,32)(H,30,33)