4-[2-[2-chloranyl-5-(trifluoromethyl)phenyl]-5-phenoxy-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-[2-chloranyl-5-(trifluoromethyl)phenyl]-5-phenoxy-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-[2-chloro-5-(trifluoromethyl)phenyl]-5-phenoxy-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-[2-chloro-5-(trifluoromethyl)phenyl]-5-phenoxy-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-[2-chloro-5-(trifluoromethyl)phenyl]-5-phenoxy-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-[2-chloro-5-(trifluoromethyl)phenyl]-5-phenoxy-1H-indol-3-yl]butylamine Formula: C25H22ClF3N2O MolecularWeight: 458.90319

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC3=C(C=C2)NC(=C3CCCCN)C4=C(C=CC(=C4)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC3=C(C=C2)NC(=C3CCCCN)C4=C(C=CC(=C4)C(F)(F)F)Cl

InChI

InChI=1S/C25H22ClF3N2O/c26-22-11-9-16(25(27,28)29)14-21(22)24-19(8-4-5-13-30)20-15-18(10-12-23(20)31-24)32-17-6-2-1-3-7-17/h1-3,6-7,9-12,14-15,31H,4-5,8,13,30H2