ethyl 2,4-dimethyl-5-[2-(6-nitroindazol-1-yl)ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[2-(6-nitroindazol-1-yl)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[2-(6-nitroindazol-1-yl)acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[2-(6-nitro-1-indazolyl)-1-oxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[2-(6-nitroindazol-1-yl)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-(6-nitroindazol-1-yl)acetyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C18H18N4O5 MolecularWeight: 370.35932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)CN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)CN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2)C

InChI

InChI=1S/C18H18N4O5/c1-4-27-18(24)16-10(2)17(20-11(16)3)15(23)9-21-14-7-13(22(25)26)6-5-12(14)8-19-21/h5-8,20H,4,9H2,1-3H3