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

Systemtic Name: 4-[4,7-bis(chloranyl)-2-(2-phenoxyphenyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[4,7-dichloro-2-(2-phenoxyphenyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[4,7-dichloro-2-(2-phenoxyphenyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[4,7-dichloro-2-(2-phenoxyphenyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[4,7-dichloro-2-(2-phenoxyphenyl)-1H-indol-3-yl]butylamine Formula: C24H22Cl2N2O MolecularWeight: 425.35028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC=C2C3=C(C4=C(C=CC(=C4N3)Cl)Cl)CCCCN

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC=C2C3=C(C4=C(C=CC(=C4N3)Cl)Cl)CCCCN

InChI

InChI=1S/C24H22Cl2N2O/c25-19-13-14-20(26)24-22(19)18(11-6-7-15-27)23(28-24)17-10-4-5-12-21(17)29-16-8-2-1-3-9-16/h1-5,8-10,12-14,28H,6-7,11,15,27H2