methyl 7-[(4-methyl-3-nitro-phenyl)carbonylamino]heptanoate

Systemtic Name: methyl 7-[(4-methyl-3-nitro-phenyl)carbonylamino]heptanoate Openeye Name: methyl 7-[(4-methyl-3-nitro-benzoyl)amino]heptanoate CAS Name: 7-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[(4-methyl-3-nitrobenzoyl)amino]heptanoate Traditional Name: 7-[(4-methyl-3-nitro-benzoyl)amino]enanthic acid methyl ester Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCCCCCC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCCCCCC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H22N2O5/c1-12-8-9-13(11-14(12)18(21)22)16(20)17-10-6-4-3-5-7-15(19)23-2/h8-9,11H,3-7,10H2,1-2H3,(H,17,20)