methyl (2R)-2-[[3,3-dimethyl-5-oxidanylidene-5-[(4-phenoxyphenyl)amino]pentanoyl]amino]-4-methyl-pentanoate

Systemtic Name: methyl (2R)-2-[[3,3-dimethyl-5-oxidanylidene-5-[(4-phenoxyphenyl)amino]pentanoyl]amino]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[[3,3-dimethyl-5-oxo-5-(4-phenoxyanilino)pentanoyl]amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[3,3-dimethyl-1,5-dioxo-5-(4-phenoxyanilino)pentyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[3,3-dimethyl-5-oxo-5-(4-phenoxyanilino)pentanoyl]amino]-4-methylpentanoate Traditional Name: (2R)-2-[[5-keto-3,3-dimethyl-5-(4-phenoxyanilino)pentanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C26H34N2O5 MolecularWeight: 454.55856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CC(C)(C)CC(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@H](C(=O)OC)NC(=O)CC(C)(C)CC(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C26H34N2O5/c1-18(2)15-22(25(31)32-5)28-24(30)17-26(3,4)16-23(29)27-19-11-13-21(14-12-19)33-20-9-7-6-8-10-20/h6-14,18,22H,15-17H2,1-5H3,(H,27,29)(H,28,30)/t22-/m1/s1