4-nitro-N-[3-oxidanylidene-3-[[2-(phenylmethyl)pyrazol-3-yl]amino]propyl]benzamide

Systemtic Name: 4-nitro-N-[3-oxidanylidene-3-[[2-(phenylmethyl)pyrazol-3-yl]amino]propyl]benzamide Openeye Name: N-[3-[(2-benzylpyrazol-3-yl)amino]-3-oxo-propyl]-4-nitro-benzamide CAS Name: 4-nitro-N-[3-oxo-3-[[2-(phenylmethyl)-3-pyrazolyl]amino]propyl]benzamide IUPAC Name: N-[3-[(2-benzylpyrazol-3-yl)amino]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-[(2-benzylpyrazol-3-yl)amino]-3-keto-propyl]-4-nitro-benzamide Formula: C20H19N5O4 MolecularWeight: 393.39596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O4/c26-19(11-12-21-20(27)16-6-8-17(9-7-16)25(28)29)23-18-10-13-22-24(18)14-15-4-2-1-3-5-15/h1-10,13H,11-12,14H2,(H,21,27)(H,23,26)