4-[3-fluoranyl-4-[(3-methylbutylamino)methyl]phenyl]-3-methyl-benzamide

Systemtic Name: 4-[3-fluoranyl-4-[(3-methylbutylamino)methyl]phenyl]-3-methyl-benzamide Openeye Name: 4-[3-fluoro-4-[(isopentylamino)methyl]phenyl]-3-methyl-benzamide CAS Name: 4-[3-fluoro-4-[(3-methylbutylamino)methyl]phenyl]-3-methylbenzamide IUPAC Name: 4-[3-fluoro-4-[(3-methylbutylamino)methyl]phenyl]-3-methylbenzamide Traditional Name: 4-[3-fluoro-4-[(isoamylamino)methyl]phenyl]-3-methyl-benzamide Formula: C20H25FN2O MolecularWeight: 328.423703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N)C2=CC(=C(C=C2)CNCCC(C)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N)C2=CC(=C(C=C2)CNCCC(C)C)F

InChI

InChI=1S/C20H25FN2O/c1-13(2)8-9-23-12-17-5-4-15(11-19(17)21)18-7-6-16(20(22)24)10-14(18)3/h4-7,10-11,13,23H,8-9,12H2,1-3H3,(H2,22,24)