4-[[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]carbonyl]fluoren-9-one

Systemtic Name: 4-[[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]carbonyl]fluoren-9-one Openeye Name: 4-[4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepane-1-carbonyl]fluoren-9-one CAS Name: 4-[[4-[(6-methyl-2-pyridinyl)methyl]-1,4-diazepan-1-yl]-oxomethyl]-9-fluorenone IUPAC Name: 4-[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepane-1-carbonyl]fluoren-9-one Traditional Name: 4-[4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepane-1-carbonyl]fluoren-9-one Formula: C26H25N3O2 MolecularWeight: 411.4956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN2CCCN(CC2)C(=O)C3=CC=CC4=C3C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=NC(=CC=C1)CN2CCCN(CC2)C(=O)C3=CC=CC4=C3C5=CC=CC=C5C4=O

InChI

InChI=1S/C26H25N3O2/c1-18-7-4-8-19(27-18)17-28-13-6-14-29(16-15-28)26(31)23-12-5-11-22-24(23)20-9-2-3-10-21(20)25(22)30/h2-5,7-12H,6,13-17H2,1H3