3,3-dimethyl-5-[[2-[(4-methylphenyl)methylcarbamoyl]phenyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 3,3-dimethyl-5-[[2-[(4-methylphenyl)methylcarbamoyl]phenyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 3,3-dimethyl-5-oxo-5-[2-(p-tolylmethylcarbamoyl)anilino]pentanoic acid CAS Name: 3,3-dimethyl-5-[2-[[(4-methylphenyl)methylamino]-oxomethyl]anilino]-5-oxopentanoic acid IUPAC Name: 3,3-dimethyl-5-[2-[(4-methylphenyl)methylcarbamoyl]anilino]-5-oxopentanoic acid Traditional Name: 5-keto-3,3-dimethyl-5-[2-[(4-methylbenzyl)carbamoyl]anilino]valeric acid Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NC(=O)CC(C)(C)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NC(=O)CC(C)(C)CC(=O)O

InChI

InChI=1S/C22H26N2O4/c1-15-8-10-16(11-9-15)14-23-21(28)17-6-4-5-7-18(17)24-19(25)12-22(2,3)13-20(26)27/h4-11H,12-14H2,1-3H3,(H,23,28)(H,24,25)(H,26,27)