4-nitro-N-[1-(4-pyrrol-1-ylphenyl)ethyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 4-nitro-N-[1-(4-pyrrol-1-ylphenyl)ethyl]-1H-pyrazole-5-carboxamide Openeye Name: 4-nitro-N-[1-(4-pyrrol-1-ylphenyl)ethyl]-1H-pyrazole-5-carboxamide CAS Name: 4-nitro-N-[1-[4-(1-pyrrolyl)phenyl]ethyl]-1H-pyrazole-5-carboxamide IUPAC Name: 4-nitro-N-[1-(4-pyrrol-1-ylphenyl)ethyl]-1H-pyrazole-5-carboxamide Traditional Name: 4-nitro-N-[1-(4-pyrrol-1-ylphenyl)ethyl]-1H-pyrazole-5-carboxamide Formula: C16H15N5O3 MolecularWeight: 325.322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CC=C2)NC(=O)C3=C(C=NN3)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=CC=C2)NC(=O)C3=C(C=NN3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O3/c1-11(18-16(22)15-14(21(23)24)10-17-19-15)12-4-6-13(7-5-12)20-8-2-3-9-20/h2-11H,1H3,(H,17,19)(H,18,22)