4-[3-[4-(3-oxidanylpropylcarbamoyl)phenyl]indazol-1-yl]benzoic acid

Systemtic Name: 4-[3-[4-(3-oxidanylpropylcarbamoyl)phenyl]indazol-1-yl]benzoic acid Openeye Name: 4-[3-[4-(3-hydroxypropylcarbamoyl)phenyl]indazol-1-yl]benzoic acid CAS Name: 4-[3-[4-[(3-hydroxypropylamino)-oxomethyl]phenyl]-1-indazolyl]benzoic acid IUPAC Name: 4-[3-[4-(3-hydroxypropylcarbamoyl)phenyl]indazol-1-yl]benzoic acid Traditional Name: 4-[3-[4-(3-hydroxypropylcarbamoyl)phenyl]indazol-1-yl]benzoic acid Formula: C24H21N3O4 MolecularWeight: 415.44124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN2C3=CC=C(C=C3)C(=O)O)C4=CC=C(C=C4)C(=O)NCCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN2C3=CC=C(C=C3)C(=O)O)C4=CC=C(C=C4)C(=O)NCCCO

InChI

InChI=1S/C24H21N3O4/c28-15-3-14-25-23(29)17-8-6-16(7-9-17)22-20-4-1-2-5-21(20)27(26-22)19-12-10-18(11-13-19)24(30)31/h1-2,4-13,28H,3,14-15H2,(H,25,29)(H,30,31)