methyl (2R)-4-methyl-2-[[(3S)-3-methyl-5-oxidanylidene-5-[(4-propan-2-ylphenyl)amino]pentanoyl]amino]pentanoate

Systemtic Name: methyl (2R)-4-methyl-2-[[(3S)-3-methyl-5-oxidanylidene-5-[(4-propan-2-ylphenyl)amino]pentanoyl]amino]pentanoate Openeye Name: methyl (2R)-2-[[(3S)-5-(4-isopropylanilino)-3-methyl-5-oxo-pentanoyl]amino]-4-methyl-pentanoate CAS Name: (2R)-4-methyl-2-[[(3S)-3-methyl-1,5-dioxo-5-(4-propan-2-ylanilino)pentyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2R)-4-methyl-2-[[(3S)-3-methyl-5-oxo-5-(4-propan-2-ylanilino)pentanoyl]amino]pentanoate Traditional Name: (2R)-2-[[(3S)-5-cumidino-5-keto-3-methyl-pentanoyl]amino]-4-methyl-valeric acid methyl ester Formula: C22H34N2O4 MolecularWeight: 390.51636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](CC(=O)NC1=CC=C(C=C1)C(C)C)CC(=O)N[C@H](CC(C)C)C(=O)OC

InChI

InChI=1S/C22H34N2O4/c1-14(2)11-19(22(27)28-6)24-21(26)13-16(5)12-20(25)23-18-9-7-17(8-10-18)15(3)4/h7-10,14-16,19H,11-13H2,1-6H3,(H,23,25)(H,24,26)/t16-,19-/m1/s1