2-(5-acetamido-2-nitro-phenyl)carbonyl-N-(5-chloranyl-2-methoxy-phenyl)pyrazolidine-1-carboxamide

Systemtic Name: 2-(5-acetamido-2-nitro-phenyl)carbonyl-N-(5-chloranyl-2-methoxy-phenyl)pyrazolidine-1-carboxamide Openeye Name: 2-(5-acetamido-2-nitro-benzoyl)-N-(5-chloro-2-methoxy-phenyl)pyrazolidine-1-carboxamide CAS Name: 2-[(5-acetamido-2-nitrophenyl)-oxomethyl]-N-(5-chloro-2-methoxyphenyl)-1-pyrazolidinecarboxamide IUPAC Name: 2-(5-acetamido-2-nitrobenzoyl)-N-(5-chloro-2-methoxyphenyl)pyrazolidine-1-carboxamide Traditional Name: 2-(5-acetamido-2-nitro-benzoyl)-N-(5-chloro-2-methoxy-phenyl)pyrazolidine-1-carboxamide Formula: C20H20ClN5O6 MolecularWeight: 461.8557

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)N2CCCN2C(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)N2CCCN2C(=O)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C20H20ClN5O6/c1-12(27)22-14-5-6-17(26(30)31)15(11-14)19(28)24-8-3-9-25(24)20(29)23-16-10-13(21)4-7-18(16)32-2/h4-7,10-11H,3,8-9H2,1-2H3,(H,22,27)(H,23,29)