4-[4-(aminomethyl)-4-piperidin-1-yl-piperidin-1-yl]-4-fluoranyl-1-phenyl-2-phenylazanyl-butan-1-one

Systemtic Name: 4-[4-(aminomethyl)-4-piperidin-1-yl-piperidin-1-yl]-4-fluoranyl-1-phenyl-2-phenylazanyl-butan-1-one Openeye Name: 4-[4-(aminomethyl)-4-(1-piperidyl)-1-piperidyl]-2-anilino-4-fluoro-1-phenyl-butan-1-one CAS Name: 4-[4-(aminomethyl)-4-(1-piperidinyl)-1-piperidinyl]-2-anilino-4-fluoro-1-phenyl-1-butanone IUPAC Name: 4-[4-(aminomethyl)-4-piperidin-1-ylpiperidin-1-yl]-2-anilino-4-fluoro-1-phenylbutan-1-one Traditional Name: 4-[4-(aminomethyl)-4-piperidino-piperidino]-2-anilino-4-fluoro-1-phenyl-butan-1-one Formula: C27H37FN4O MolecularWeight: 452.607283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2(CCN(CC2)C(CC(C(=O)C3=CC=CC=C3)NC4=CC=CC=C4)F)CN

Isomeric SMILES

C1CCN(CC1)C2(CCN(CC2)C(CC(C(=O)C3=CC=CC=C3)NC4=CC=CC=C4)F)CN

InChI

InChI=1S/C27H37FN4O/c28-25(31-18-14-27(21-29,15-19-31)32-16-8-3-9-17-32)20-24(30-23-12-6-2-7-13-23)26(33)22-10-4-1-5-11-22/h1-2,4-7,10-13,24-25,30H,3,8-9,14-21,29H2