2-azanyl-4-[4-[(4-fluoranylphenoxy)methyl]-3-methoxy-phenyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-[4-[(4-fluoranylphenoxy)methyl]-3-methoxy-phenyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile Openeye Name: 2-amino-4-[4-[(4-fluorophenoxy)methyl]-3-methoxy-phenyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile CAS Name: 2-amino-4-[4-[(4-fluorophenoxy)methyl]-3-methoxyphenyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile IUPAC Name: 2-amino-4-[4-[(4-fluorophenoxy)methyl]-3-methoxyphenyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile Traditional Name: 2-amino-4-[4-[(4-fluorophenoxy)methyl]-3-methoxy-phenyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile Formula: C25H24FN3O2 MolecularWeight: 417.475363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=C(C(=NC3=C2CCCCC3)N)C#N)COC4=CC=C(C=C4)F

Isomeric SMILES

COC1=C(C=CC(=C1)C2=C(C(=NC3=C2CCCCC3)N)C#N)COC4=CC=C(C=C4)F

InChI

InChI=1S/C25H24FN3O2/c1-30-23-13-16(7-8-17(23)15-31-19-11-9-18(26)10-12-19)24-20-5-3-2-4-6-22(20)29-25(28)21(24)14-27/h7-13H,2-6,15H2,1H3,(H2,28,29)