2-[1-[3-[(3-cyano-7-propyl-1H-indol-6-yl)oxy]propyl]indol-4-yl]oxy-2-methyl-propanoic acid

Systemtic Name: 2-[1-[3-[(3-cyano-7-propyl-1H-indol-6-yl)oxy]propyl]indol-4-yl]oxy-2-methyl-propanoic acid Openeye Name: 2-[1-[3-[(3-cyano-7-propyl-1H-indol-6-yl)oxy]propyl]indol-4-yl]oxy-2-methyl-propanoic acid CAS Name: 2-[[1-[3-[(3-cyano-7-propyl-1H-indol-6-yl)oxy]propyl]-4-indolyl]oxy]-2-methylpropanoic acid IUPAC Name: 2-[1-[3-[(3-cyano-7-propyl-1H-indol-6-yl)oxy]propyl]indol-4-yl]oxy-2-methylpropanoic acid Traditional Name: 2-[1-[3-[(3-cyano-7-propyl-1H-indol-6-yl)oxy]propyl]indol-4-yl]oxy-2-methyl-propionic acid Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1NC=C2C#N)OCCCN3C=CC4=C3C=CC=C4OC(C)(C)C(=O)O

Isomeric SMILES

CCCC1=C(C=CC2=C1NC=C2C#N)OCCCN3C=CC4=C3C=CC=C4OC(C)(C)C(=O)O

InChI

InChI=1S/C27H29N3O4/c1-4-7-21-23(11-10-19-18(16-28)17-29-25(19)21)33-15-6-13-30-14-12-20-22(30)8-5-9-24(20)34-27(2,3)26(31)32/h5,8-12,14,17,29H,4,6-7,13,15H2,1-3H3,(H,31,32)