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

Systemtic Name: ethyl 2,5-dimethyl-4-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[2-(5-phenyltetrazol-2-yl)acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[2-(5-phenyltetrazol-2-yl)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-4-[2-(5-phenyltetrazol-2-yl)acetyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)CN2N=C(N=N2)C3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)CN2N=C(N=N2)C3=CC=CC=C3)C)C

InChI

InChI=1S/C18H19N5O3/c1-4-26-18(25)16-12(3)19-11(2)15(16)14(24)10-23-21-17(20-22-23)13-8-6-5-7-9-13/h5-9,19H,4,10H2,1-3H3