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

Systemtic Name: 4-[4,7-bis(chloranyl)-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[4,7-dichloro-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[4,7-dichloro-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[4,7-dichloro-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[4,7-dichloro-2-(3,4-dimethoxyphenyl)-1H-indol-3-yl]butylamine Formula: C20H22Cl2N2O2 MolecularWeight: 393.30688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C3=C(C=CC(=C3N2)Cl)Cl)CCCCN)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C3=C(C=CC(=C3N2)Cl)Cl)CCCCN)OC

InChI

InChI=1S/C20H22Cl2N2O2/c1-25-16-9-6-12(11-17(16)26-2)19-13(5-3-4-10-23)18-14(21)7-8-15(22)20(18)24-19/h6-9,11,24H,3-5,10,23H2,1-2H3