4-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]amino]-3-nitro-benzamide

Systemtic Name: 4-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]amino]-3-nitro-benzamide Openeye Name: 4-[(1-benzylpyrazol-4-yl)methyl-methyl-amino]-3-nitro-benzamide CAS Name: 4-[methyl-[[1-(phenylmethyl)-4-pyrazolyl]methyl]amino]-3-nitrobenzamide IUPAC Name: 4-[(1-benzylpyrazol-4-yl)methyl-methylamino]-3-nitrobenzamide Traditional Name: 4-[(1-benzylpyrazol-4-yl)methyl-methyl-amino]-3-nitro-benzamide Formula: C19H19N5O3 MolecularWeight: 365.38586

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O3/c1-22(17-8-7-16(19(20)25)9-18(17)24(26)27)11-15-10-21-23(13-15)12-14-5-3-2-4-6-14/h2-10,13H,11-12H2,1H3,(H2,20,25)