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

Systemtic Name: 4-[4-(aminomethyl)-4-pyrrolidin-1-yl-piperidin-1-yl]-2-azanyl-4-fluoranyl-1-phenyl-butan-1-one Openeye Name: 2-amino-4-[4-(aminomethyl)-4-pyrrolidin-1-yl-1-piperidyl]-4-fluoro-1-phenyl-butan-1-one CAS Name: 2-amino-4-[4-(aminomethyl)-4-(1-pyrrolidinyl)-1-piperidinyl]-4-fluoro-1-phenyl-1-butanone IUPAC Name: 2-amino-4-[4-(aminomethyl)-4-pyrrolidin-1-ylpiperidin-1-yl]-4-fluoro-1-phenylbutan-1-one Traditional Name: 2-amino-4-[4-(aminomethyl)-4-pyrrolidino-piperidino]-4-fluoro-1-phenyl-butan-1-one Formula: C20H31FN4O MolecularWeight: 362.484743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2(CCN(CC2)C(CC(C(=O)C3=CC=CC=C3)N)F)CN

Isomeric SMILES

C1CCN(C1)C2(CCN(CC2)C(CC(C(=O)C3=CC=CC=C3)N)F)CN

InChI

InChI=1S/C20H31FN4O/c21-18(14-17(23)19(26)16-6-2-1-3-7-16)24-12-8-20(15-22,9-13-24)25-10-4-5-11-25/h1-3,6-7,17-18H,4-5,8-15,22-23H2