[(2S)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3,5-dimethyl-4-[(1S)-1-oxidanylethyl]-1H-pyrrole-2-carboxylate

Systemtic Name: [(2S)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3,5-dimethyl-4-[(1S)-1-oxidanylethyl]-1H-pyrrole-2-carboxylate Openeye Name: [(1S)-1-allophanoyl-2-methyl-propyl] 4-[(1S)-1-hydroxyethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(1S)-1-hydroxyethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid [(2S)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2S)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 4-[(1S)-1-hydroxyethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(1S)-1-hydroxyethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid [(1S)-1-allophanoyl-2-methyl-propyl] ester Formula: C15H23N3O5 MolecularWeight: 325.36022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(C)O)C)C(=O)OC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CC1=C(NC(=C1[C@H](C)O)C)C(=O)O[C@@H](C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C15H23N3O5/c1-6(2)12(13(20)18-15(16)22)23-14(21)11-7(3)10(9(5)19)8(4)17-11/h6,9,12,17,19H,1-5H3,(H3,16,18,20,22)/t9-,12-/m0/s1