2-azanyl-5-[4-(2,3-dimethylphenyl)carbonylphenoxy]-2-methyl-5-phenyl-pentanoic acid

Systemtic Name: 2-azanyl-5-[4-(2,3-dimethylphenyl)carbonylphenoxy]-2-methyl-5-phenyl-pentanoic acid Openeye Name: 2-amino-5-[4-(2,3-dimethylbenzoyl)phenoxy]-2-methyl-5-phenyl-pentanoic acid CAS Name: 2-amino-5-[4-[(2,3-dimethylphenyl)-oxomethyl]phenoxy]-2-methyl-5-phenylpentanoic acid IUPAC Name: 2-amino-5-[4-(2,3-dimethylbenzoyl)phenoxy]-2-methyl-5-phenylpentanoic acid Traditional Name: 2-amino-5-[4-(2,3-dimethylbenzoyl)phenoxy]-2-methyl-5-phenyl-valeric acid Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1C)C(=O)C2=CC=C(C=C2)OC(CCC(C)(C(=O)O)N)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1C)C(=O)C2=CC=C(C=C2)OC(CCC(C)(C(=O)O)N)C3=CC=CC=C3

InChI

InChI=1S/C27H29NO4/c1-18-8-7-11-23(19(18)2)25(29)21-12-14-22(15-13-21)32-24(20-9-5-4-6-10-20)16-17-27(3,28)26(30)31/h4-15,24H,16-17,28H2,1-3H3,(H,30,31)