[(2S)-1-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-3,3-dimethyl-1-oxidanylidene-4-(2-oxidanylidenepyrrolidin-1-yl)butan-2-yl] benzoate

Systemtic Name: [(2S)-1-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-3,3-dimethyl-1-oxidanylidene-4-(2-oxidanylidenepyrrolidin-1-yl)butan-2-yl] benzoate Openeye Name: [(1S)-1-[(2-ethoxy-2-oxo-ethyl)carbamoyl]-2,2-dimethyl-3-(2-oxopyrrolidin-1-yl)propyl] benzoate CAS Name: benzoic acid [(2S)-1-[(2-ethoxy-2-oxoethyl)amino]-3,3-dimethyl-1-oxo-4-(2-oxo-1-pyrrolidinyl)butan-2-yl] ester IUPAC Name: [(2S)-1-[(2-ethoxy-2-oxoethyl)amino]-3,3-dimethyl-1-oxo-4-(2-oxopyrrolidin-1-yl)butan-2-yl] benzoate Traditional Name: benzoic acid [(1S)-1-[(2-ethoxy-2-keto-ethyl)carbamoyl]-3-(2-ketopyrrolidino)-2,2-dimethyl-propyl] ester Formula: C21H28N2O6 MolecularWeight: 404.45682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C(C(C)(C)CN1CCCC1=O)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CNC(=O)[C@H](C(C)(C)CN1CCCC1=O)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H28N2O6/c1-4-28-17(25)13-22-19(26)18(29-20(27)15-9-6-5-7-10-15)21(2,3)14-23-12-8-11-16(23)24/h5-7,9-10,18H,4,8,11-14H2,1-3H3,(H,22,26)/t18-/m1/s1