N-[(S)-cyclopropyl(phenyl)methyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide

Systemtic Name: N-[(S)-cyclopropyl(phenyl)methyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide Openeye Name: N-[(S)-cyclopropyl(phenyl)methyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide CAS Name: N-[(S)-cyclopropyl(phenyl)methyl]-4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]benzamide IUPAC Name: N-[(S)-cyclopropyl(phenyl)methyl]-4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzamide Traditional Name: N-[(S)-cyclopropyl(phenyl)methyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC(C3CC3)C4=CC=CC=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)N[C@@H](C3CC3)C4=CC=CC=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O3/c1-15-22(27(29)30)16(2)26(25-15)14-17-8-10-20(11-9-17)23(28)24-21(19-12-13-19)18-6-4-3-5-7-18/h3-11,19,21H,12-14H2,1-2H3,(H,24,28)/t21-/m1/s1