2-aminocarbonyl-7-(3-chloranyl-4-methyl-phenyl)-2-[5-(3,4-dimethylphenyl)pentoxymethyl]heptanoic acid

Systemtic Name: 2-aminocarbonyl-7-(3-chloranyl-4-methyl-phenyl)-2-[5-(3,4-dimethylphenyl)pentoxymethyl]heptanoic acid Openeye Name: 2-carbamoyl-7-(3-chloro-4-methyl-phenyl)-2-[5-(3,4-dimethylphenyl)pentoxymethyl]heptanoic acid CAS Name: 2-carbamoyl-7-(3-chloro-4-methylphenyl)-2-[5-(3,4-dimethylphenyl)pentoxymethyl]heptanoic acid IUPAC Name: 2-carbamoyl-7-(3-chloro-4-methylphenyl)-2-[5-(3,4-dimethylphenyl)pentoxymethyl]heptanoic acid Traditional Name: 2-carbamoyl-7-(3-chloro-4-methyl-phenyl)-2-[5-(3,4-dimethylphenyl)pentoxymethyl]enanthic acid Formula: C29H40ClNO4 MolecularWeight: 502.0852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCCCCOCC(CCCCCC2=CC(=C(C=C2)C)Cl)(C(=O)N)C(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)CCCCCOCC(CCCCCC2=CC(=C(C=C2)C)Cl)(C(=O)N)C(=O)O)C

InChI

InChI=1S/C29H40ClNO4/c1-21-12-14-24(18-23(21)3)10-7-5-9-17-35-20-29(27(31)32,28(33)34)16-8-4-6-11-25-15-13-22(2)26(30)19-25/h12-15,18-19H,4-11,16-17,20H2,1-3H3,(H2,31,32)(H,33,34)