2-[4-(5-indol-1-ylpentoxy)phenyl]ethanenitrile

Systemtic Name: 2-[4-(5-indol-1-ylpentoxy)phenyl]ethanenitrile Openeye Name: 2-[4-(5-indol-1-ylpentoxy)phenyl]acetonitrile CAS Name: 2-[4-[5-(1-indolyl)pentoxy]phenyl]acetonitrile IUPAC Name: 2-[4-(5-indol-1-ylpentoxy)phenyl]acetonitrile Traditional Name: 2-[4-(5-indol-1-ylpentoxy)phenyl]acetonitrile Formula: C21H22N2O MolecularWeight: 318.41218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN2CCCCCOC3=CC=C(C=C3)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CN2CCCCCOC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C21H22N2O/c22-14-12-18-8-10-20(11-9-18)24-17-5-1-4-15-23-16-13-19-6-2-3-7-21(19)23/h2-3,6-11,13,16H,1,4-5,12,15,17H2