2-[[3-[(2R)-2-[[(2S)-2-oxidanyl-3-(3-oxidanyl-2-phenylmethoxy-phenoxy)propyl]amino]propyl]-1H-indol-7-yl]amino]ethanoic acid

Systemtic Name: 2-[[3-[(2R)-2-[[(2S)-2-oxidanyl-3-(3-oxidanyl-2-phenylmethoxy-phenoxy)propyl]amino]propyl]-1H-indol-7-yl]amino]ethanoic acid Openeye Name: 2-[[3-[(2R)-2-[[(2S)-3-(2-benzyloxy-3-hydroxy-phenoxy)-2-hydroxy-propyl]amino]propyl]-1H-indol-7-yl]amino]acetic acid CAS Name: 2-[[3-[(2R)-2-[[(2S)-2-hydroxy-3-(3-hydroxy-2-phenylmethoxyphenoxy)propyl]amino]propyl]-1H-indol-7-yl]amino]acetic acid IUPAC Name: 2-[[3-[(2R)-2-[[(2S)-2-hydroxy-3-(3-hydroxy-2-phenylmethoxyphenoxy)propyl]amino]propyl]-1H-indol-7-yl]amino]acetic acid Traditional Name: 2-[[3-[(2R)-2-[[(2S)-3-(2-benzoxy-3-hydroxy-phenoxy)-2-hydroxy-propyl]amino]propyl]-1H-indol-7-yl]amino]acetic acid Formula: C29H33N3O6 MolecularWeight: 519.58882

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=C1C=CC=C2NCC(=O)O)NCC(COC3=CC=CC(=C3OCC4=CC=CC=C4)O)O

Isomeric SMILES

C[C@H](CC1=CNC2=C1C=CC=C2NCC(=O)O)NC[C@@H](COC3=CC=CC(=C3OCC4=CC=CC=C4)O)O

InChI

InChI=1S/C29H33N3O6/c1-19(13-21-14-32-28-23(21)9-5-10-24(28)31-16-27(35)36)30-15-22(33)18-37-26-12-6-11-25(34)29(26)38-17-20-7-3-2-4-8-20/h2-12,14,19,22,30-34H,13,15-18H2,1H3,(H,35,36)/t19-,22+/m1/s1