3-[[3-(2-azanylethyl)-5-dibenzofuran-1-yl-indol-1-yl]methyl]benzoic acid

Systemtic Name: 3-[[3-(2-azanylethyl)-5-dibenzofuran-1-yl-indol-1-yl]methyl]benzoic acid Openeye Name: 3-[[3-(2-aminoethyl)-5-dibenzofuran-1-yl-indol-1-yl]methyl]benzoic acid CAS Name: 3-[[3-(2-aminoethyl)-5-(1-dibenzofuranyl)-1-indolyl]methyl]benzoic acid IUPAC Name: 3-[[3-(2-aminoethyl)-5-dibenzofuran-1-ylindol-1-yl]methyl]benzoic acid Traditional Name: 3-[[3-(2-aminoethyl)-5-dibenzofuran-1-yl-indol-1-yl]methyl]benzoic acid Formula: C30H24N2O3 MolecularWeight: 460.52316

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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)CC6=CC=CC(=C6)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C=CC=C3O2)C4=CC5=C(C=C4)N(C=C5CCN)CC6=CC=CC(=C6)C(=O)O

InChI

InChI=1S/C30H24N2O3/c31-14-13-22-18-32(17-19-5-3-6-21(15-19)30(33)34)26-12-11-20(16-25(22)26)23-8-4-10-28-29(23)24-7-1-2-9-27(24)35-28/h1-12,15-16,18H,13-14,17,31H2,(H,33,34)