N-cyclopropyl-3-nitro-4-[2-(1-phenylpyrazol-4-yl)ethylamino]benzamide

Systemtic Name: N-cyclopropyl-3-nitro-4-[2-(1-phenylpyrazol-4-yl)ethylamino]benzamide Openeye Name: N-cyclopropyl-3-nitro-4-[2-(1-phenylpyrazol-4-yl)ethylamino]benzamide CAS Name: N-cyclopropyl-3-nitro-4-[2-(1-phenyl-4-pyrazolyl)ethylamino]benzamide IUPAC Name: N-cyclopropyl-3-nitro-4-[2-(1-phenylpyrazol-4-yl)ethylamino]benzamide Traditional Name: N-cyclopropyl-3-nitro-4-[2-(1-phenylpyrazol-4-yl)ethylamino]benzamide Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=C(C=C2)NCCC3=CN(N=C3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=O)C2=CC(=C(C=C2)NCCC3=CN(N=C3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O3/c27-21(24-17-7-8-17)16-6-9-19(20(12-16)26(28)29)22-11-10-15-13-23-25(14-15)18-4-2-1-3-5-18/h1-6,9,12-14,17,22H,7-8,10-11H2,(H,24,27)