5-(2-chloranylpropanoylamino)-N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide

Systemtic Name: 5-(2-chloranylpropanoylamino)-N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Openeye Name: 5-(2-chloropropanoylamino)-N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide CAS Name: 5-[(2-chloro-1-oxopropyl)amino]-N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide IUPAC Name: 5-(2-chloropropanoylamino)-N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Traditional Name: 5-(2-chloropropanoylamino)-N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Formula: C25H30ClN3O2 MolecularWeight: 439.9776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NC4CCCCC4)Cl

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)N2CCC3=CC=CC=C3C2)C(=O)NC4CCCCC4)Cl

InChI

InChI=1S/C25H30ClN3O2/c1-17(26)24(30)28-21-11-12-23(29-14-13-18-7-5-6-8-19(18)16-29)22(15-21)25(31)27-20-9-3-2-4-10-20/h5-8,11-12,15,17,20H,2-4,9-10,13-14,16H2,1H3,(H,27,31)(H,28,30)