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

Systemtic Name: 4-[5-bromanyl-7-chloranyl-2-(3,4-diethoxyphenyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-bromo-7-chloro-2-(3,4-diethoxyphenyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-bromo-7-chloro-2-(3,4-diethoxyphenyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-bromo-7-chloro-2-(3,4-diethoxyphenyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[5-bromo-7-chloro-2-(3,4-diethoxyphenyl)-1H-indol-3-yl]butylamine Formula: C22H26BrClN2O2 MolecularWeight: 465.81104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=C(C3=CC(=CC(=C3N2)Cl)Br)CCCCN)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=C(C3=CC(=CC(=C3N2)Cl)Br)CCCCN)OCC

InChI

InChI=1S/C22H26BrClN2O2/c1-3-27-19-9-8-14(11-20(19)28-4-2)21-16(7-5-6-10-25)17-12-15(23)13-18(24)22(17)26-21/h8-9,11-13,26H,3-7,10,25H2,1-2H3