4-[7-bromanyl-5-chloranyl-2-(3-phenoxyphenyl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[7-bromanyl-5-chloranyl-2-(3-phenoxyphenyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[7-bromo-5-chloro-2-(3-phenoxyphenyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[7-bromo-5-chloro-2-(3-phenoxyphenyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[7-bromo-5-chloro-2-(3-phenoxyphenyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[7-bromo-5-chloro-2-(3-phenoxyphenyl)-1H-indol-3-yl]butylamine Formula: C24H22BrClN2O MolecularWeight: 469.80128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C3=C(C4=CC(=CC(=C4N3)Br)Cl)CCCCN

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)C3=C(C4=CC(=CC(=C4N3)Br)Cl)CCCCN

InChI

InChI=1S/C24H22BrClN2O/c25-22-15-17(26)14-21-20(11-4-5-12-27)23(28-24(21)22)16-7-6-10-19(13-16)29-18-8-2-1-3-9-18/h1-3,6-10,13-15,28H,4-5,11-12,27H2