(3R)-1-[4-(2-methoxyethylamino)-3-nitro-phenyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3R)-1-[4-(2-methoxyethylamino)-3-nitro-phenyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3R)-1-[4-(2-methoxyethylamino)-3-nitro-phenyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-[4-(2-methoxyethylamino)-3-nitrophenyl]-5-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3R)-1-[4-(2-methoxyethylamino)-3-nitrophenyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-5-keto-1-[4-(2-methoxyethylamino)-3-nitro-phenyl]pyrrolidine-3-carboxylate Formula: C14H16N3O6- MolecularWeight: 322.29334

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C=C(C=C1)N2C[C@@H](CC2=O)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O6/c1-23-5-4-15-11-3-2-10(7-12(11)17(21)22)16-8-9(14(19)20)6-13(16)18/h2-3,7,9,15H,4-6,8H2,1H3,(H,19,20)/p-1/t9-/m1/s1