3-[4-[4-[(3-phenyl-7-propyl-1H-indazol-6-yl)oxy]butylamino]phenyl]propanoic acid

Systemtic Name: 3-[4-[4-[(3-phenyl-7-propyl-1H-indazol-6-yl)oxy]butylamino]phenyl]propanoic acid Openeye Name: 3-[4-[4-[(3-phenyl-7-propyl-1H-indazol-6-yl)oxy]butylamino]phenyl]propanoic acid CAS Name: 3-[4-[4-[(3-phenyl-7-propyl-1H-indazol-6-yl)oxy]butylamino]phenyl]propanoic acid IUPAC Name: 3-[4-[4-[(3-phenyl-7-propyl-1H-indazol-6-yl)oxy]butylamino]phenyl]propanoic acid Traditional Name: 3-[4-[4-[(3-phenyl-7-propyl-1H-indazol-6-yl)oxy]butylamino]phenyl]propionic acid Formula: C29H33N3O3 MolecularWeight: 471.59062

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1NN=C2C3=CC=CC=C3)OCCCCNC4=CC=C(C=C4)CCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC2=C1NN=C2C3=CC=CC=C3)OCCCCNC4=CC=C(C=C4)CCC(=O)O

InChI

InChI=1S/C29H33N3O3/c1-2-8-24-26(17-16-25-28(31-32-29(24)25)22-9-4-3-5-10-22)35-20-7-6-19-30-23-14-11-21(12-15-23)13-18-27(33)34/h3-5,9-12,14-17,30H,2,6-8,13,18-20H2,1H3,(H,31,32)(H,33,34)