2-[3-[[ethyl(9H-fluoren-9-ylmethoxycarbonyl)amino]methyl]indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-[[ethyl(9H-fluoren-9-ylmethoxycarbonyl)amino]methyl]indol-1-yl]ethanoic acid Openeye Name: 2-[3-[[ethyl(9H-fluoren-9-ylmethoxycarbonyl)amino]methyl]indol-1-yl]acetic acid CAS Name: 2-[3-[[ethyl-[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]methyl]-1-indolyl]acetic acid IUPAC Name: 2-[3-[[ethyl(9H-fluoren-9-ylmethoxycarbonyl)amino]methyl]indol-1-yl]acetic acid Traditional Name: 2-[3-[[ethyl(9H-fluoren-9-ylmethoxycarbonyl)amino]methyl]indol-1-yl]acetic acid Formula: C28H26N2O4 MolecularWeight: 454.51704

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CN(C2=CC=CC=C21)CC(=O)O)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

CCN(CC1=CN(C2=CC=CC=C21)CC(=O)O)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C28H26N2O4/c1-2-29(15-19-16-30(17-27(31)32)26-14-8-7-9-20(19)26)28(33)34-18-25-23-12-5-3-10-21(23)22-11-4-6-13-24(22)25/h3-14,16,25H,2,15,17-18H2,1H3,(H,31,32)