4-[3-(2-azanylethyl)-5-dibenzofuran-1-yl-indol-1-yl]butanoic acid

Systemtic Name: 4-[3-(2-azanylethyl)-5-dibenzofuran-1-yl-indol-1-yl]butanoic acid Openeye Name: 4-[3-(2-aminoethyl)-5-dibenzofuran-1-yl-indol-1-yl]butanoic acid CAS Name: 4-[3-(2-aminoethyl)-5-(1-dibenzofuranyl)-1-indolyl]butanoic acid IUPAC Name: 4-[3-(2-aminoethyl)-5-dibenzofuran-1-ylindol-1-yl]butanoic acid Traditional Name: 4-[3-(2-aminoethyl)-5-dibenzofuran-1-yl-indol-1-yl]butyric acid Formula: C26H24N2O3 MolecularWeight: 412.48036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C=CC=C3O2)C4=CC5=C(C=C4)N(C=C5CCN)CCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C=CC=C3O2)C4=CC5=C(C=C4)N(C=C5CCN)CCCC(=O)O

InChI

InChI=1S/C26H24N2O3/c27-13-12-18-16-28(14-4-9-25(29)30)22-11-10-17(15-21(18)22)19-6-3-8-24-26(19)20-5-1-2-7-23(20)31-24/h1-3,5-8,10-11,15-16H,4,9,12-14,27H2,(H,29,30)