2-[[2-[2-(2-tert-butylphenoxy)ethanoylamino]-4-methyl-pentanoyl]amino]-3-(4-hydroxyphenyl)propanoate

Systemtic Name: 2-[[2-[2-(2-tert-butylphenoxy)ethanoylamino]-4-methyl-pentanoyl]amino]-3-(4-hydroxyphenyl)propanoate Openeye Name: 2-[[2-[[2-(2-tert-butylphenoxy)acetyl]amino]-4-methyl-pentanoyl]amino]-3-(4-hydroxyphenyl)propanoate CAS Name: 2-[[2-[[2-(2-tert-butylphenoxy)-1-oxoethyl]amino]-4-methyl-1-oxopentyl]amino]-3-(4-hydroxyphenyl)propanoate IUPAC Name: 2-[[2-[[2-(2-tert-butylphenoxy)acetyl]amino]-4-methylpentanoyl]amino]-3-(4-hydroxyphenyl)propanoate Traditional Name: 2-[[2-[[2-(2-tert-butylphenoxy)acetyl]amino]-4-methyl-pentanoyl]amino]-3-(4-hydroxyphenyl)propionate Formula: C27H35N2O6- MolecularWeight: 483.5766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=C(C=C1)O)C(=O)[O-])NC(=O)COC2=CC=CC=C2C(C)(C)C

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=C(C=C1)O)C(=O)[O-])NC(=O)COC2=CC=CC=C2C(C)(C)C

InChI

InChI=1S/C27H36N2O6/c1-17(2)14-21(25(32)29-22(26(33)34)15-18-10-12-19(30)13-11-18)28-24(31)16-35-23-9-7-6-8-20(23)27(3,4)5/h6-13,17,21-22,30H,14-16H2,1-5H3,(H,28,31)(H,29,32)(H,33,34)/p-1