2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-[1-[(3-methylphenyl)methyl]pyrazol-4-yl]propanamide

Systemtic Name: 2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-[1-[(3-methylphenyl)methyl]pyrazol-4-yl]propanamide Openeye Name: 2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-[1-(m-tolylmethyl)pyrazol-4-yl]propanamide CAS Name: 2-(3-methoxy-4-nitro-1-pyrazolyl)-N-[1-[(3-methylphenyl)methyl]-4-pyrazolyl]propanamide IUPAC Name: 2-(3-methoxy-4-nitropyrazol-1-yl)-N-[1-[(3-methylphenyl)methyl]pyrazol-4-yl]propanamide Traditional Name: 2-(3-methoxy-4-nitro-pyrazol-1-yl)-N-[1-(3-methylbenzyl)pyrazol-4-yl]propionamide Formula: C18H20N6O4 MolecularWeight: 384.3892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=C(C=N2)NC(=O)C(C)N3C=C(C(=N3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=C(C=N2)NC(=O)C(C)N3C=C(C(=N3)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H20N6O4/c1-12-5-4-6-14(7-12)9-22-10-15(8-19-22)20-17(25)13(2)23-11-16(24(26)27)18(21-23)28-3/h4-8,10-11,13H,9H2,1-3H3,(H,20,25)