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

Systemtic Name: N-methyl-3-nitro-4-[(phenylmethyl)amino]-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Openeye Name: 4-(benzylamino)-N-methyl-3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide CAS Name: N-methyl-3-nitro-4-[(phenylmethyl)amino]-N-[(1-phenyl-4-pyrazolyl)methyl]benzamide IUPAC Name: 4-(benzylamino)-N-methyl-3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Traditional Name: 4-(benzylamino)-N-methyl-3-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)NCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)NCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H23N5O3/c1-28(17-20-16-27-29(18-20)22-10-6-3-7-11-22)25(31)21-12-13-23(24(14-21)30(32)33)26-15-19-8-4-2-5-9-19/h2-14,16,18,26H,15,17H2,1H3