N-[4-[[[3-(aminomethyl)phenyl]methyl-cyclopropylcarbonyl-amino]methyl]phenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-[[[3-(aminomethyl)phenyl]methyl-cyclopropylcarbonyl-amino]methyl]phenyl]-4-fluoranyl-benzamide Openeye Name: N-[4-[[[3-(aminomethyl)phenyl]methyl-(cyclopropanecarbonyl)amino]methyl]phenyl]-4-fluoro-benzamide CAS Name: N-[4-[[[3-(aminomethyl)phenyl]methyl-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]-4-fluorobenzamide IUPAC Name: N-[4-[[[3-(aminomethyl)phenyl]methyl-(cyclopropanecarbonyl)amino]methyl]phenyl]-4-fluorobenzamide Traditional Name: N-[4-[[[3-(aminomethyl)benzyl]-(cyclopropanecarbonyl)amino]methyl]phenyl]-4-fluoro-benzamide Formula: C26H26FN3O2 MolecularWeight: 431.501943

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N(CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)F)CC4=CC=CC(=C4)CN

Isomeric SMILES

C1CC1C(=O)N(CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)F)CC4=CC=CC(=C4)CN

InChI

InChI=1S/C26H26FN3O2/c27-23-10-8-21(9-11-23)25(31)29-24-12-4-18(5-13-24)16-30(26(32)22-6-7-22)17-20-3-1-2-19(14-20)15-28/h1-5,8-14,22H,6-7,15-17,28H2,(H,29,31)