N-[(4-tert-butylphenyl)methyl]-N,1-dimethyl-5-nitro-pyrrole-2-carboxamide

Systemtic Name: N-[(4-tert-butylphenyl)methyl]-N,1-dimethyl-5-nitro-pyrrole-2-carboxamide Openeye Name: N-[(4-tert-butylphenyl)methyl]-N,1-dimethyl-5-nitro-pyrrole-2-carboxamide CAS Name: N-[(4-tert-butylphenyl)methyl]-N,1-dimethyl-5-nitro-2-pyrrolecarboxamide IUPAC Name: N-[(4-tert-butylphenyl)methyl]-N,1-dimethyl-5-nitropyrrole-2-carboxamide Traditional Name: N-(4-tert-butylbenzyl)-N,1-dimethyl-5-nitro-pyrrole-2-carboxamide Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(C)C(=O)C2=CC=C(N2C)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(C)C(=O)C2=CC=C(N2C)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O3/c1-18(2,3)14-8-6-13(7-9-14)12-19(4)17(22)15-10-11-16(20(15)5)21(23)24/h6-11H,12H2,1-5H3