[2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(2-phenoxyethanoylamino)butanoate

Systemtic Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(2-phenoxyethanoylamino)butanoate Openeye Name: [2-[[(1R)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl] (2S)-3-methyl-2-[(2-phenoxyacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenoxyethyl)amino]butanoic acid [2-[[[[(2R)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxoethyl] (2S)-3-methyl-2-[(2-phenoxyacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenoxyacetyl)amino]butyric acid [2-keto-2-[[(1R)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C20H29N3O6 MolecularWeight: 407.46076

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)COC(=O)C(C(C)C)NC(=O)COC1=CC=CC=C1

Isomeric SMILES

CC[C@@H](C)NC(=O)NC(=O)COC(=O)[C@H](C(C)C)NC(=O)COC1=CC=CC=C1

InChI

InChI=1S/C20H29N3O6/c1-5-14(4)21-20(27)23-17(25)12-29-19(26)18(13(2)3)22-16(24)11-28-15-9-7-6-8-10-15/h6-10,13-14,18H,5,11-12H2,1-4H3,(H,22,24)(H2,21,23,25,27)/t14-,18+/m1/s1