5-(4-chloranylbutanoylamino)-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide

Systemtic Name: 5-(4-chloranylbutanoylamino)-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Openeye Name: 5-(4-chlorobutanoylamino)-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide CAS Name: 5-[(4-chloro-1-oxobutyl)amino]-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide IUPAC Name: 5-(4-chlorobutanoylamino)-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Traditional Name: 5-(4-chlorobutanoylamino)-N-cyclopropyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Formula: C23H26ClN3O2 MolecularWeight: 411.92444

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=C(C=CC(=C2)NC(=O)CCCCl)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CC1NC(=O)C2=C(C=CC(=C2)NC(=O)CCCCl)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H26ClN3O2/c24-12-3-6-22(28)25-19-9-10-21(20(14-19)23(29)26-18-7-8-18)27-13-11-16-4-1-2-5-17(16)15-27/h1-2,4-5,9-10,14,18H,3,6-8,11-13,15H2,(H,25,28)(H,26,29)