2-[2-methyl-1-[4-(3-phenylmethoxypropoxy)phenyl]carbonyl-indol-4-yl]ethanoic acid

Systemtic Name: 2-[2-methyl-1-[4-(3-phenylmethoxypropoxy)phenyl]carbonyl-indol-4-yl]ethanoic acid Openeye Name: 2-[1-[4-(3-benzyloxypropoxy)benzoyl]-2-methyl-indol-4-yl]acetic acid CAS Name: 2-[2-methyl-1-[oxo-[4-(3-phenylmethoxypropoxy)phenyl]methyl]-4-indolyl]acetic acid IUPAC Name: 2-[2-methyl-1-[4-(3-phenylmethoxypropoxy)benzoyl]indol-4-yl]acetic acid Traditional Name: 2-[1-[4-(3-benzoxypropoxy)benzoyl]-2-methyl-indol-4-yl]acetic acid Formula: C28H27NO5 MolecularWeight: 457.51768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCCCOCC4=CC=CC=C4)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCCCOCC4=CC=CC=C4)CC(=O)O

InChI

InChI=1S/C28H27NO5/c1-20-17-25-23(18-27(30)31)9-5-10-26(25)29(20)28(32)22-11-13-24(14-12-22)34-16-6-15-33-19-21-7-3-2-4-8-21/h2-5,7-14,17H,6,15-16,18-19H2,1H3,(H,30,31)