[4-chloranylbutyl(ethoxycarbonyl)amino] 2-methyl-6-nitro-benzoate

Systemtic Name: [4-chloranylbutyl(ethoxycarbonyl)amino] 2-methyl-6-nitro-benzoate Openeye Name: [4-chlorobutyl(ethoxycarbonyl)amino] 2-methyl-6-nitro-benzoate CAS Name: 2-methyl-6-nitrobenzoic acid [4-chlorobutyl(ethoxycarbonyl)amino] ester IUPAC Name: [4-chlorobutyl(ethoxycarbonyl)amino] 2-methyl-6-nitrobenzoate Traditional Name: 2-methyl-6-nitro-benzoic acid [carbethoxy(4-chlorobutyl)amino] ester Formula: C15H19ClN2O6 MolecularWeight: 358.77416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(CCCCCl)OC(=O)C1=C(C=CC=C1[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)N(CCCCCl)OC(=O)C1=C(C=CC=C1[N+](=O)[O-])C

InChI

InChI=1S/C15H19ClN2O6/c1-3-23-15(20)17(10-5-4-9-16)24-14(19)13-11(2)7-6-8-12(13)18(21)22/h6-8H,3-5,9-10H2,1-2H3