methyl 8-[(4-chloranyl-3-nitro-phenyl)amino]-8-oxidanylidene-octanoate

Systemtic Name: methyl 8-[(4-chloranyl-3-nitro-phenyl)amino]-8-oxidanylidene-octanoate Openeye Name: methyl 8-(4-chloro-3-nitro-anilino)-8-oxo-octanoate CAS Name: 8-(4-chloro-3-nitroanilino)-8-oxooctanoic acid methyl ester IUPAC Name: methyl 8-(4-chloro-3-nitroanilino)-8-oxooctanoate Traditional Name: 8-(4-chloro-3-nitro-anilino)-8-keto-caprylic acid methyl ester Formula: C15H19ClN2O5 MolecularWeight: 342.77476

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCC(=O)NC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCCCCCC(=O)NC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H19ClN2O5/c1-23-15(20)7-5-3-2-4-6-14(19)17-11-8-9-12(16)13(10-11)18(21)22/h8-10H,2-7H2,1H3,(H,17,19)