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

Systemtic Name: 2-aminocarbonyl-7-(4-chlorophenyl)-2-[5-(3,4-dimethylphenyl)pentoxymethyl]heptanoic acid Openeye Name: 2-carbamoyl-7-(4-chlorophenyl)-2-[5-(3,4-dimethylphenyl)pentoxymethyl]heptanoic acid CAS Name: 2-carbamoyl-7-(4-chlorophenyl)-2-[5-(3,4-dimethylphenyl)pentoxymethyl]heptanoic acid IUPAC Name: 2-carbamoyl-7-(4-chlorophenyl)-2-[5-(3,4-dimethylphenyl)pentoxymethyl]heptanoic acid Traditional Name: 2-carbamoyl-7-(4-chlorophenyl)-2-[5-(3,4-dimethylphenyl)pentoxymethyl]enanthic acid Formula: C28H38ClNO4 MolecularWeight: 488.05862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H38ClNO4/c1-21-11-12-24(19-22(21)2)10-6-4-8-18-34-20-28(26(30)31,27(32)33)17-7-3-5-9-23-13-15-25(29)16-14-23/h11-16,19H,3-10,17-18,20H2,1-2H3,(H2,30,31)(H,32,33)