4-[3-[[[4-(2-ethylindol-1-yl)phenyl]amino]methyl]phenoxy]butanenitrile

Systemtic Name: 4-[3-[[[4-(2-ethylindol-1-yl)phenyl]amino]methyl]phenoxy]butanenitrile Openeye Name: 4-[3-[[4-(2-ethylindol-1-yl)anilino]methyl]phenoxy]butanenitrile CAS Name: 4-[3-[[4-(2-ethyl-1-indolyl)anilino]methyl]phenoxy]butanenitrile IUPAC Name: 4-[3-[[4-(2-ethylindol-1-yl)anilino]methyl]phenoxy]butanenitrile Traditional Name: 4-[3-[[4-(2-ethylindol-1-yl)anilino]methyl]phenoxy]butyronitrile Formula: C27H27N3O MolecularWeight: 409.52278

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=CC=CC=C2N1C3=CC=C(C=C3)NCC4=CC(=CC=C4)OCCCC#N

Isomeric SMILES

CCC1=CC2=CC=CC=C2N1C3=CC=C(C=C3)NCC4=CC(=CC=C4)OCCCC#N

InChI

InChI=1S/C27H27N3O/c1-2-24-19-22-9-3-4-11-27(22)30(24)25-14-12-23(13-15-25)29-20-21-8-7-10-26(18-21)31-17-6-5-16-28/h3-4,7-15,18-19,29H,2,5-6,17,20H2,1H3