methyl 2-[2-(2-chloranyl-4-nitro-phenoxy)ethanoylamino]-3-methyl-pentanoate

Systemtic Name: methyl 2-[2-(2-chloranyl-4-nitro-phenoxy)ethanoylamino]-3-methyl-pentanoate Openeye Name: methyl 2-[[2-(2-chloro-4-nitro-phenoxy)acetyl]amino]-3-methyl-pentanoate CAS Name: 2-[[2-(2-chloro-4-nitrophenoxy)-1-oxoethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-(2-chloro-4-nitrophenoxy)acetyl]amino]-3-methylpentanoate Traditional Name: 2-[[2-(2-chloro-4-nitro-phenoxy)acetyl]amino]-3-methyl-valeric acid methyl ester Formula: C15H19ClN2O6 MolecularWeight: 358.77416

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)COC1=C(C=C(C=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)COC1=C(C=C(C=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H19ClN2O6/c1-4-9(2)14(15(20)23-3)17-13(19)8-24-12-6-5-10(18(21)22)7-11(12)16/h5-7,9,14H,4,8H2,1-3H3,(H,17,19)