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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC(=N2)NC(=O)CCN3C=C(C(=N3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC(=N2)NC(=O)CCN3C=C(C(=N3)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H20N6O4/c1-13-5-3-4-6-14(13)11-22-9-7-16(20-22)19-17(25)8-10-23-12-15(24(26)27)18(21-23)28-2/h3-7,9,12H,8,10-11H2,1-2H3,(H,19,20,25)