ethyl 2-[(2,4-dinitropyrrol-1-yl)methyl]-5-nitro-benzoate

Systemtic Name: ethyl 2-[(2,4-dinitropyrrol-1-yl)methyl]-5-nitro-benzoate Openeye Name: ethyl 2-[(2,4-dinitropyrrol-1-yl)methyl]-5-nitro-benzoate CAS Name: 2-[(2,4-dinitro-1-pyrrolyl)methyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 2-[(2,4-dinitropyrrol-1-yl)methyl]-5-nitrobenzoate Traditional Name: 2-[(2,4-dinitropyrrol-1-yl)methyl]-5-nitro-benzoic acid ethyl ester Formula: C14H12N4O8 MolecularWeight: 364.26708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])CN2C=C(C=C2[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])CN2C=C(C=C2[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O8/c1-2-26-14(19)12-5-10(16(20)21)4-3-9(12)7-15-8-11(17(22)23)6-13(15)18(24)25/h3-6,8H,2,7H2,1H3