3-(4-fluorophenyl)-1-[1-[3-(3-methoxyphenyl)propyl-prop-2-enyl-amino]propyl]-3H-2-benzofuran-1-carbonitrile

Systemtic Name: 3-(4-fluorophenyl)-1-[1-[3-(3-methoxyphenyl)propyl-prop-2-enyl-amino]propyl]-3H-2-benzofuran-1-carbonitrile Openeye Name: 1-[1-[allyl-[3-(3-methoxyphenyl)propyl]amino]propyl]-3-(4-fluorophenyl)-3H-isobenzofuran-1-carbonitrile CAS Name: 3-(4-fluorophenyl)-1-[1-[3-(3-methoxyphenyl)propyl-prop-2-enylamino]propyl]-3H-isobenzofuran-1-carbonitrile IUPAC Name: 3-(4-fluorophenyl)-1-[1-[3-(3-methoxyphenyl)propyl-prop-2-enylamino]propyl]-3H-2-benzofuran-1-carbonitrile Traditional Name: 1-[1-[allyl-[3-(3-methoxyphenyl)propyl]amino]propyl]-3-(4-fluorophenyl)phthalan-1-carbonitrile Formula: C31H33FN2O2 MolecularWeight: 484.604323

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1(C2=CC=CC=C2C(O1)C3=CC=C(C=C3)F)C#N)N(CCCC4=CC(=CC=C4)OC)CC=C

Isomeric SMILES

CCC(C1(C2=CC=CC=C2C(O1)C3=CC=C(C=C3)F)C#N)N(CCCC4=CC(=CC=C4)OC)CC=C

InChI

InChI=1S/C31H33FN2O2/c1-4-19-34(20-9-11-23-10-8-12-26(21-23)35-3)29(5-2)31(22-33)28-14-7-6-13-27(28)30(36-31)24-15-17-25(32)18-16-24/h4,6-8,10,12-18,21,29-30H,1,5,9,11,19-20H2,2-3H3