[2-[bis(2-methylpropyl)amino]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate

Systemtic Name: [2-[bis(2-methylpropyl)amino]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate Openeye Name: [2-(diisobutylamino)-2-oxo-ethyl] (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate CAS Name: (2S)-2-[[anilino(oxo)methyl]amino]-3-methylbutanoic acid [2-[bis(2-methylpropyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[bis(2-methylpropyl)amino]-2-oxoethyl] (2S)-3-methyl-2-(phenylcarbamoylamino)butanoate Traditional Name: (2S)-3-methyl-2-(phenylcarbamoylamino)butyric acid [2-(diisobutylamino)-2-keto-ethyl] ester Formula: C22H35N3O4 MolecularWeight: 405.531

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C(=O)COC(=O)C(C(C)C)NC(=O)NC1=CC=CC=C1

Isomeric SMILES

CC(C)CN(CC(C)C)C(=O)COC(=O)[C@H](C(C)C)NC(=O)NC1=CC=CC=C1

InChI

InChI=1S/C22H35N3O4/c1-15(2)12-25(13-16(3)4)19(26)14-29-21(27)20(17(5)6)24-22(28)23-18-10-8-7-9-11-18/h7-11,15-17,20H,12-14H2,1-6H3,(H2,23,24,28)/t20-/m0/s1