methyl 2-[1-(4-chloranyl-2-nitro-phenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[1-(4-chloranyl-2-nitro-phenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[1-(4-chloro-2-nitro-benzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(4-chloro-2-nitrophenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-(4-chloro-2-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(4-chloro-2-nitro-benzoyl)-3-keto-piperazin-2-yl]acetic acid methyl ester Formula: C14H14ClN3O6 MolecularWeight: 355.73046

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)NCCN1C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CC1C(=O)NCCN1C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H14ClN3O6/c1-24-12(19)7-11-13(20)16-4-5-17(11)14(21)9-3-2-8(15)6-10(9)18(22)23/h2-3,6,11H,4-5,7H2,1H3,(H,16,20)