2-[4-[(5-fluoranyl-1H-indol-2-yl)methyl]-1,4-diazepan-1-yl]benzenecarbonitrile

Systemtic Name: 2-[4-[(5-fluoranyl-1H-indol-2-yl)methyl]-1,4-diazepan-1-yl]benzenecarbonitrile Openeye Name: 2-[4-[(5-fluoro-1H-indol-2-yl)methyl]-1,4-diazepan-1-yl]benzonitrile CAS Name: 2-[4-[(5-fluoro-1H-indol-2-yl)methyl]-1,4-diazepan-1-yl]benzonitrile IUPAC Name: 2-[4-[(5-fluoro-1H-indol-2-yl)methyl]-1,4-diazepan-1-yl]benzonitrile Traditional Name: 2-[4-[(5-fluoro-1H-indol-2-yl)methyl]-1,4-diazepan-1-yl]benzonitrile Formula: C21H21FN4 MolecularWeight: 348.416643

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=CC=CC=C2C#N)CC3=CC4=C(N3)C=CC(=C4)F

Isomeric SMILES

C1CN(CCN(C1)C2=CC=CC=C2C#N)CC3=CC4=C(N3)C=CC(=C4)F

InChI

InChI=1S/C21H21FN4/c22-18-6-7-20-17(12-18)13-19(24-20)15-25-8-3-9-26(11-10-25)21-5-2-1-4-16(21)14-23/h1-2,4-7,12-13,24H,3,8-11,15H2