tert-butyl N-[(E,2R)-4-cyano-4-(4-nitrophenyl)-3-oxidanyl-1-oxidanylidene-1-pyrrolidin-2-yl-but-3-en-2-yl]carbamate

Systemtic Name: tert-butyl N-[(E,2R)-4-cyano-4-(4-nitrophenyl)-3-oxidanyl-1-oxidanylidene-1-pyrrolidin-2-yl-but-3-en-2-yl]carbamate Openeye Name: tert-butyl N-[(E,1R)-3-cyano-2-hydroxy-3-(4-nitrophenyl)-1-(pyrrolidine-2-carbonyl)allyl]carbamate CAS Name: N-[(E,2R)-4-cyano-3-hydroxy-4-(4-nitrophenyl)-1-oxo-1-(2-pyrrolidinyl)but-3-en-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E,2R)-4-cyano-3-hydroxy-4-(4-nitrophenyl)-1-oxo-1-pyrrolidin-2-ylbut-3-en-2-yl]carbamate Traditional Name: N-[(E,1R)-3-cyano-2-hydroxy-3-(4-nitrophenyl)-1-prolyl-allyl]carbamic acid tert-butyl ester Formula: C20H24N4O6 MolecularWeight: 416.42776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C(=O)C1CCCN1)C(=C(C#N)C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](C(=O)C1CCCN1)/C(=C(\C#N)/C2=CC=C(C=C2)[N+](=O)[O-])/O

InChI

InChI=1S/C20H24N4O6/c1-20(2,3)30-19(27)23-16(18(26)15-5-4-10-22-15)17(25)14(11-21)12-6-8-13(9-7-12)24(28)29/h6-9,15-16,22,25H,4-5,10H2,1-3H3,(H,23,27)/b17-14-/t15?,16-/m1/s1