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

Systemtic Name: methyl 2,4-dimethyl-5-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-(5-phenyltetrazol-2-yl)acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-(5-phenyltetrazol-2-yl)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-(5-phenyltetrazol-2-yl)acetyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)CN2N=C(N=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)CN2N=C(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H17N5O3/c1-10-14(17(24)25-3)11(2)18-15(10)13(23)9-22-20-16(19-21-22)12-7-5-4-6-8-12/h4-8,18H,9H2,1-3H3