2-aminocarbonyl-8-(3,4-dimethylphenyl)-2-(5-naphthalen-2-ylpentoxymethyl)octanoic acid

Systemtic Name: 2-aminocarbonyl-8-(3,4-dimethylphenyl)-2-(5-naphthalen-2-ylpentoxymethyl)octanoic acid Openeye Name: 2-carbamoyl-8-(3,4-dimethylphenyl)-2-[5-(2-naphthyl)pentoxymethyl]octanoic acid CAS Name: 2-carbamoyl-8-(3,4-dimethylphenyl)-2-[5-(2-naphthalenyl)pentoxymethyl]octanoic acid IUPAC Name: 2-carbamoyl-8-(3,4-dimethylphenyl)-2-(5-naphthalen-2-ylpentoxymethyl)octanoic acid Traditional Name: 2-carbamoyl-8-(3,4-dimethylphenyl)-2-[5-(2-naphthyl)pentoxymethyl]caprylic acid Formula: C33H43NO4 MolecularWeight: 517.69882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCCCCCC(COCCCCCC2=CC3=CC=CC=C3C=C2)(C(=O)N)C(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)CCCCCCC(COCCCCCC2=CC3=CC=CC=C3C=C2)(C(=O)N)C(=O)O)C

InChI

InChI=1S/C33H43NO4/c1-25-16-17-27(22-26(25)2)12-6-3-4-10-20-33(31(34)35,32(36)37)24-38-21-11-5-7-13-28-18-19-29-14-8-9-15-30(29)23-28/h8-9,14-19,22-23H,3-7,10-13,20-21,24H2,1-2H3,(H2,34,35)(H,36,37)