1-[3-(4-octylphenoxy)-2-oxidanylidene-propyl]indole-5-carbonitrile

Systemtic Name: 1-[3-(4-octylphenoxy)-2-oxidanylidene-propyl]indole-5-carbonitrile Openeye Name: 1-[3-(4-octylphenoxy)-2-oxo-propyl]indole-5-carbonitrile CAS Name: 1-[3-(4-octylphenoxy)-2-oxopropyl]-5-indolecarbonitrile IUPAC Name: 1-[3-(4-octylphenoxy)-2-oxopropyl]indole-5-carbonitrile Traditional Name: 1-[2-keto-3-(4-octylphenoxy)propyl]indole-5-carbonitrile Formula: C26H30N2O2 MolecularWeight: 402.5286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)OCC(=O)CN2C=CC3=C2C=CC(=C3)C#N

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)OCC(=O)CN2C=CC3=C2C=CC(=C3)C#N

InChI

InChI=1S/C26H30N2O2/c1-2-3-4-5-6-7-8-21-9-12-25(13-10-21)30-20-24(29)19-28-16-15-23-17-22(18-27)11-14-26(23)28/h9-17H,2-8,19-20H2,1H3