[(2R)-1-oxidanylidene-1-[[(1R)-1-phenylbutyl]amino]propan-2-yl] 1H-pyrrole-2-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-[[(1R)-1-phenylbutyl]amino]propan-2-yl] 1H-pyrrole-2-carboxylate Openeye Name: [(1R)-1-methyl-2-oxo-2-[[(1R)-1-phenylbutyl]amino]ethyl] 1H-pyrrole-2-carboxylate CAS Name: 1H-pyrrole-2-carboxylic acid [(2R)-1-oxo-1-[[(1R)-1-phenylbutyl]amino]propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-[[(1R)-1-phenylbutyl]amino]propan-2-yl] 1H-pyrrole-2-carboxylate Traditional Name: 1H-pyrrole-2-carboxylic acid [(1R)-2-keto-1-methyl-2-[[(1R)-1-phenylbutyl]amino]ethyl] ester Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)C2=CC=CN2

Isomeric SMILES

CCC[C@H](C1=CC=CC=C1)NC(=O)[C@@H](C)OC(=O)C2=CC=CN2

InChI

InChI=1S/C18H22N2O3/c1-3-8-15(14-9-5-4-6-10-14)20-17(21)13(2)23-18(22)16-11-7-12-19-16/h4-7,9-13,15,19H,3,8H2,1-2H3,(H,20,21)/t13-,15-/m1/s1