3-[4-[[2-(4-chloranylphenoxy)pyridin-3-yl]methylamino]butyl]-1H-indole-5-carbonitrile

Systemtic Name: 3-[4-[[2-(4-chloranylphenoxy)pyridin-3-yl]methylamino]butyl]-1H-indole-5-carbonitrile Openeye Name: 3-[4-[[2-(4-chlorophenoxy)-3-pyridyl]methylamino]butyl]-1H-indole-5-carbonitrile CAS Name: 3-[4-[[2-(4-chlorophenoxy)-3-pyridinyl]methylamino]butyl]-1H-indole-5-carbonitrile IUPAC Name: 3-[4-[[2-(4-chlorophenoxy)pyridin-3-yl]methylamino]butyl]-1H-indole-5-carbonitrile Traditional Name: 3-[4-[[2-(4-chlorophenoxy)-3-pyridyl]methylamino]butyl]-1H-indole-5-carbonitrile Formula: C25H23ClN4O MolecularWeight: 430.92932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)OC2=CC=C(C=C2)Cl)CNCCCCC3=CNC4=C3C=C(C=C4)C#N

Isomeric SMILES

C1=CC(=C(N=C1)OC2=CC=C(C=C2)Cl)CNCCCCC3=CNC4=C3C=C(C=C4)C#N

InChI

InChI=1S/C25H23ClN4O/c26-21-7-9-22(10-8-21)31-25-20(5-3-13-29-25)16-28-12-2-1-4-19-17-30-24-11-6-18(15-27)14-23(19)24/h3,5-11,13-14,17,28,30H,1-2,4,12,16H2