4-[2-(4-butoxyphenyl)-5-iodanyl-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(4-butoxyphenyl)-5-iodanyl-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(4-butoxyphenyl)-5-iodo-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(4-butoxyphenyl)-5-iodo-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(4-butoxyphenyl)-5-iodo-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(4-butoxyphenyl)-5-iodo-1H-indol-3-yl]butylamine Formula: C22H27IN2O MolecularWeight: 462.36705

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)I)CCCCN

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)I)CCCCN

InChI

InChI=1S/C22H27IN2O/c1-2-3-14-26-18-10-7-16(8-11-18)22-19(6-4-5-13-24)20-15-17(23)9-12-21(20)25-22/h7-12,15,25H,2-6,13-14,24H2,1H3