2-azanyl-5-[2-(3,5-ditert-butylphenyl)ethanoylamino]pentanoic acid

Systemtic Name: 2-azanyl-5-[2-(3,5-ditert-butylphenyl)ethanoylamino]pentanoic acid Openeye Name: 2-amino-5-[[2-(3,5-ditert-butylphenyl)acetyl]amino]pentanoic acid CAS Name: 2-amino-5-[[2-(3,5-ditert-butylphenyl)-1-oxoethyl]amino]pentanoic acid IUPAC Name: 2-amino-5-[[2-(3,5-ditert-butylphenyl)acetyl]amino]pentanoic acid Traditional Name: 2-amino-5-[[2-(3,5-ditert-butylphenyl)acetyl]amino]valeric acid Formula: C21H34N2O3 MolecularWeight: 362.50626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)CC(=O)NCCCC(C(=O)O)N)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)CC(=O)NCCCC(C(=O)O)N)C(C)(C)C

InChI

InChI=1S/C21H34N2O3/c1-20(2,3)15-10-14(11-16(13-15)21(4,5)6)12-18(24)23-9-7-8-17(22)19(25)26/h10-11,13,17H,7-9,12,22H2,1-6H3,(H,23,24)(H,25,26)