3-[2-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]-4-[(4-methoxynaphthalen-1-yl)methoxy]phenyl]propanoic acid

Systemtic Name: 3-[2-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]-4-[(4-methoxynaphthalen-1-yl)methoxy]phenyl]propanoic acid Openeye Name: 3-[2-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]-4-[(4-methoxy-1-naphthyl)methoxy]phenyl]propanoic acid CAS Name: 3-[2-[[[1-(3,5-dimethylphenyl)-3-methylbutyl]amino]-oxomethyl]-4-[(4-methoxy-1-naphthalenyl)methoxy]phenyl]propanoic acid IUPAC Name: 3-[2-[[1-(3,5-dimethylphenyl)-3-methylbutyl]carbamoyl]-4-[(4-methoxynaphthalen-1-yl)methoxy]phenyl]propanoic acid Traditional Name: 3-[2-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]-4-[(4-methoxy-1-naphthyl)methoxy]phenyl]propionic acid Formula: C35H39NO5 MolecularWeight: 553.68786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(CC(C)C)NC(=O)C2=C(C=CC(=C2)OCC3=CC=C(C4=CC=CC=C34)OC)CCC(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(CC(C)C)NC(=O)C2=C(C=CC(=C2)OCC3=CC=C(C4=CC=CC=C34)OC)CCC(=O)O)C

InChI

InChI=1S/C35H39NO5/c1-22(2)16-32(27-18-23(3)17-24(4)19-27)36-35(39)31-20-28(13-10-25(31)12-15-34(37)38)41-21-26-11-14-33(40-5)30-9-7-6-8-29(26)30/h6-11,13-14,17-20,22,32H,12,15-16,21H2,1-5H3,(H,36,39)(H,37,38)