tert-butyl 2-[[3-ethoxy-3-oxidanylidene-2-(phenylmethyl)propanoyl]amino]-4-methyl-pentanoate

Systemtic Name: tert-butyl 2-[[3-ethoxy-3-oxidanylidene-2-(phenylmethyl)propanoyl]amino]-4-methyl-pentanoate Openeye Name: tert-butyl 2-[(2-benzyl-3-ethoxy-3-oxo-propanoyl)amino]-4-methyl-pentanoate CAS Name: 2-[[3-ethoxy-1,3-dioxo-2-(phenylmethyl)propyl]amino]-4-methylpentanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2-benzyl-3-ethoxy-3-oxopropanoyl)amino]-4-methylpentanoate Traditional Name: 2-[(2-benzyl-3-ethoxy-3-keto-propanoyl)amino]-4-methyl-valeric acid tert-butyl ester Formula: C22H33NO5 MolecularWeight: 391.50112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)C(=O)NC(CC(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)C(=O)NC(CC(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H33NO5/c1-7-27-20(25)17(14-16-11-9-8-10-12-16)19(24)23-18(13-15(2)3)21(26)28-22(4,5)6/h8-12,15,17-18H,7,13-14H2,1-6H3,(H,23,24)