2-[2-methyl-1-(3-phenylpropyl)-5-[(2-phenyl-1,3-thiazol-4-yl)methoxy]indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-methyl-1-(3-phenylpropyl)-5-[(2-phenyl-1,3-thiazol-4-yl)methoxy]indol-3-yl]ethanoic acid Openeye Name: 2-[2-methyl-1-(3-phenylpropyl)-5-[(2-phenylthiazol-4-yl)methoxy]indol-3-yl]acetic acid CAS Name: 2-[2-methyl-1-(3-phenylpropyl)-5-[(2-phenyl-4-thiazolyl)methoxy]-3-indolyl]acetic acid IUPAC Name: 2-[2-methyl-1-(3-phenylpropyl)-5-[(2-phenyl-1,3-thiazol-4-yl)methoxy]indol-3-yl]acetic acid Traditional Name: 2-[2-methyl-1-(3-phenylpropyl)-5-[(2-phenylthiazol-4-yl)methoxy]indol-3-yl]acetic acid Formula: C30H28N2O3S MolecularWeight: 496.61992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CCCC3=CC=CC=C3)C=CC(=C2)OCC4=CSC(=N4)C5=CC=CC=C5)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CCCC3=CC=CC=C3)C=CC(=C2)OCC4=CSC(=N4)C5=CC=CC=C5)CC(=O)O

InChI

InChI=1S/C30H28N2O3S/c1-21-26(18-29(33)34)27-17-25(35-19-24-20-36-30(31-24)23-12-6-3-7-13-23)14-15-28(27)32(21)16-8-11-22-9-4-2-5-10-22/h2-7,9-10,12-15,17,20H,8,11,16,18-19H2,1H3,(H,33,34)