4-[2-(5-bromanyl-2-methoxy-phenyl)-5-ethoxy-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(5-bromanyl-2-methoxy-phenyl)-5-ethoxy-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(5-bromo-2-methoxy-phenyl)-5-ethoxy-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(5-bromo-2-methoxyphenyl)-5-ethoxy-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(5-bromo-2-methoxyphenyl)-5-ethoxy-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(5-bromo-2-methoxy-phenyl)-5-ethoxy-1H-indol-3-yl]butylamine Formula: C21H25BrN2O2 MolecularWeight: 417.3394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=C2CCCCN)C3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=C2CCCCN)C3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C21H25BrN2O2/c1-3-26-15-8-9-19-17(13-15)16(6-4-5-11-23)21(24-19)18-12-14(22)7-10-20(18)25-2/h7-10,12-13,24H,3-6,11,23H2,1-2H3