N-(3-azanylpropyl)-N-[[3-(3,3-dimethylbutanoylamino)phenyl]methyl]-3-fluoranyl-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[[3-(3,3-dimethylbutanoylamino)phenyl]methyl]-3-fluoranyl-benzamide Openeye Name: N-(3-aminopropyl)-N-[[3-(3,3-dimethylbutanoylamino)phenyl]methyl]-3-fluoro-benzamide CAS Name: N-(3-aminopropyl)-N-[[3-[(3,3-dimethyl-1-oxobutyl)amino]phenyl]methyl]-3-fluorobenzamide IUPAC Name: N-(3-aminopropyl)-N-[[3-(3,3-dimethylbutanoylamino)phenyl]methyl]-3-fluorobenzamide Traditional Name: N-(3-aminopropyl)-N-[3-(3,3-dimethylbutanoylamino)benzyl]-3-fluoro-benzamide Formula: C23H30FN3O2 MolecularWeight: 399.501603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=CC=CC(=C1)CN(CCCN)C(=O)C2=CC(=CC=C2)F

Isomeric SMILES

CC(C)(C)CC(=O)NC1=CC=CC(=C1)CN(CCCN)C(=O)C2=CC(=CC=C2)F

InChI

InChI=1S/C23H30FN3O2/c1-23(2,3)15-21(28)26-20-10-4-7-17(13-20)16-27(12-6-11-25)22(29)18-8-5-9-19(24)14-18/h4-5,7-10,13-14H,6,11-12,15-16,25H2,1-3H3,(H,26,28)