2-[4-[(1-butyl-4-methoxy-indol-2-yl)methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[(1-butyl-4-methoxy-indol-2-yl)methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(1-butyl-4-methoxy-indol-2-yl)methyl]phenyl]benzonitrile CAS Name: 2-[4-[(1-butyl-4-methoxy-2-indolyl)methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(1-butyl-4-methoxyindol-2-yl)methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(1-butyl-4-methoxy-indol-2-yl)methyl]phenyl]benzonitrile Formula: C27H26N2O MolecularWeight: 394.50814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C1CC3=CC=C(C=C3)C4=CC=CC=C4C#N)C(=CC=C2)OC

Isomeric SMILES

CCCCN1C2=C(C=C1CC3=CC=C(C=C3)C4=CC=CC=C4C#N)C(=CC=C2)OC

InChI

InChI=1S/C27H26N2O/c1-3-4-16-29-23(18-25-26(29)10-7-11-27(25)30-2)17-20-12-14-21(15-13-20)24-9-6-5-8-22(24)19-28/h5-15,18H,3-4,16-17H2,1-2H3