N-[3-(2-methylphenoxy)-5-nitro-phenyl]-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[3-(2-methylphenoxy)-5-nitro-phenyl]-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[3-(2-methylphenoxy)-5-nitro-phenyl]-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[3-(2-methylphenoxy)-5-nitrophenyl]-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[3-(2-methylphenoxy)-5-nitrophenyl]-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[3-(2-methylphenoxy)-5-nitro-phenyl]-3-(4-nitropyrazol-1-yl)propionamide Formula: C19H17N5O6 MolecularWeight: 411.36818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CCN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CCN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O6/c1-13-4-2-3-5-18(13)30-17-9-14(8-15(10-17)23(26)27)21-19(25)6-7-22-12-16(11-20-22)24(28)29/h2-5,8-12H,6-7H2,1H3,(H,21,25)