ethyl (Z,2R,3R)-5-azanyl-4-cyano-3-(furan-2-yl)-2-(4-nitrophenyl)carbonyl-hex-4-enoate

Systemtic Name: ethyl (Z,2R,3R)-5-azanyl-4-cyano-3-(furan-2-yl)-2-(4-nitrophenyl)carbonyl-hex-4-enoate Openeye Name: ethyl (Z,2R,3R)-5-amino-4-cyano-3-(2-furyl)-2-(4-nitrobenzoyl)hex-4-enoate CAS Name: (Z,2R,3R)-5-amino-4-cyano-3-(2-furanyl)-2-[(4-nitrophenyl)-oxomethyl]-4-hexenoic acid ethyl ester IUPAC Name: ethyl (Z,2R,3R)-5-amino-4-cyano-3-(furan-2-yl)-2-(4-nitrobenzoyl)hex-4-enoate Traditional Name: (Z,2R,3R)-5-amino-4-cyano-3-(2-furyl)-2-(4-nitrobenzoyl)hex-4-enoic acid ethyl ester Formula: C20H19N3O6 MolecularWeight: 397.38136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CO1)C(=C(C)N)C#N)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)[C@H]([C@@H](C1=CC=CO1)/C(=C(\C)/N)/C#N)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O6/c1-3-28-20(25)18(19(24)13-6-8-14(9-7-13)23(26)27)17(15(11-21)12(2)22)16-5-4-10-29-16/h4-10,17-18H,3,22H2,1-2H3/b15-12+/t17-,18-/m1/s1