4-[[3-(2-azanylethyl)-1H-indol-2-yl]-(1H-indol-3-yl)methyl]-2-methoxy-phenol; ethanoic acid

Systemtic Name: 4-[[3-(2-azanylethyl)-1H-indol-2-yl]-(1H-indol-3-yl)methyl]-2-methoxy-phenol; ethanoic acid Openeye Name: acetic acid; 4-[[3-(2-aminoethyl)-1H-indol-2-yl]-(1H-indol-3-yl)methyl]-2-methoxy-phenol CAS Name: acetic acid; 4-[[3-(2-aminoethyl)-1H-indol-2-yl]-(1H-indol-3-yl)methyl]-2-methoxyphenol IUPAC Name: acetic acid; 4-[[3-(2-aminoethyl)-1H-indol-2-yl]-(1H-indol-3-yl)methyl]-2-methoxyphenol Traditional Name: acetic acid; 4-[[3-(2-aminoethyl)-1H-indol-2-yl]-(1H-indol-3-yl)methyl]-2-methoxy-phenol Formula: C28H29N3O4 MolecularWeight: 471.54756

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.COC1=C(C=CC(=C1)C(C2=CNC3=CC=CC=C32)C4=C(C5=CC=CC=C5N4)CCN)O

Isomeric SMILES

CC(=O)O.COC1=C(C=CC(=C1)C(C2=CNC3=CC=CC=C32)C4=C(C5=CC=CC=C5N4)CCN)O

InChI

InChI=1S/C26H25N3O2.C2H4O2/c1-31-24-14-16(10-11-23(24)30)25(20-15-28-21-8-4-2-7-18(20)21)26-19(12-13-27)17-6-3-5-9-22(17)29-26;1-2(3)4/h2-11,14-15,25,28-30H,12-13,27H2,1H3;1H3,(H,3,4)