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

Systemtic Name: 4-[2-(1,3-benzodioxol-5-yl)-5-bromanyl-7-chloranyl-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(1,3-benzodioxol-5-yl)-5-bromo-7-chloro-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(1,3-benzodioxol-5-yl)-5-bromo-7-chloro-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(1,3-benzodioxol-5-yl)-5-bromo-7-chloro-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(1,3-benzodioxol-5-yl)-5-bromo-7-chloro-1H-indol-3-yl]butylamine Formula: C19H18BrClN2O2 MolecularWeight: 421.71542

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(C4=CC(=CC(=C4N3)Cl)Br)CCCCN

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(C4=CC(=CC(=C4N3)Cl)Br)CCCCN

InChI

InChI=1S/C19H18BrClN2O2/c20-12-8-14-13(3-1-2-6-22)18(23-19(14)15(21)9-12)11-4-5-16-17(7-11)25-10-24-16/h4-5,7-9,23H,1-3,6,10,22H2