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

Systemtic Name: 4-[2-(3,4-diethoxyphenyl)-5-phenoxy-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(3,4-diethoxyphenyl)-5-phenoxy-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(3,4-diethoxyphenyl)-5-phenoxy-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(3,4-diethoxyphenyl)-5-phenoxy-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(3,4-diethoxyphenyl)-5-phenoxy-1H-indol-3-yl]butylamine Formula: C28H32N2O3 MolecularWeight: 444.56528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)OC4=CC=CC=C4)CCCCN)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)OC4=CC=CC=C4)CCCCN)OCC

InChI

InChI=1S/C28H32N2O3/c1-3-31-26-16-13-20(18-27(26)32-4-2)28-23(12-8-9-17-29)24-19-22(14-15-25(24)30-28)33-21-10-6-5-7-11-21/h5-7,10-11,13-16,18-19,30H,3-4,8-9,12,17,29H2,1-2H3