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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=CC(=N2)NC(=O)CCN3C=C(C(=N3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=CC(=N2)NC(=O)CCN3C=C(C(=N3)OC)[N+](=O)[O-]

InChI

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