3-[2-[(5-ethylpyridin-3-yl)methylamino]-1-oxidanyl-ethyl]-17-fluoranyl-9-propyl-14-oxa-4,9-diazabicyclo[13.3.1]nonadeca-1(19),15,17-triene-5,8-dione

Systemtic Name: 3-[2-[(5-ethylpyridin-3-yl)methylamino]-1-oxidanyl-ethyl]-17-fluoranyl-9-propyl-14-oxa-4,9-diazabicyclo[13.3.1]nonadeca-1(19),15,17-triene-5,8-dione Openeye Name: 3-[2-[(5-ethyl-3-pyridyl)methylamino]-1-hydroxy-ethyl]-17-fluoro-9-propyl-14-oxa-4,9-diazabicyclo[13.3.1]nonadeca-1(19),15,17-triene-5,8-dione CAS Name: 3-[2-[(5-ethyl-3-pyridinyl)methylamino]-1-hydroxyethyl]-17-fluoro-9-propyl-14-oxa-4,9-diazabicyclo[13.3.1]nonadeca-1(19),15,17-triene-5,8-dione IUPAC Name: 3-[2-[(5-ethylpyridin-3-yl)methylamino]-1-hydroxyethyl]-17-fluoro-9-propyl-14-oxa-4,9-diazabicyclo[13.3.1]nonadeca-1(19),15,17-triene-5,8-dione Traditional Name: 3-[2-[(5-ethyl-3-pyridyl)methylamino]-1-hydroxy-ethyl]-17-fluoro-9-propyl-14-oxa-4,9-diazabicyclo[13.3.1]nonadeca-1(19),15,17-triene-5,8-quinone Formula: C29H41FN4O4 MolecularWeight: 528.658643

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCCCOC2=CC(=CC(=C2)CC(NC(=O)CCC1=O)C(CNCC3=CN=CC(=C3)CC)O)F

Isomeric SMILES

CCCN1CCCCOC2=CC(=CC(=C2)CC(NC(=O)CCC1=O)C(CNCC3=CN=CC(=C3)CC)O)F

InChI

InChI=1S/C29H41FN4O4/c1-3-9-34-10-5-6-11-38-25-14-22(13-24(30)16-25)15-26(33-28(36)7-8-29(34)37)27(35)20-32-19-23-12-21(4-2)17-31-18-23/h12-14,16-18,26-27,32,35H,3-11,15,19-20H2,1-2H3,(H,33,36)