N-[[(E)-2-methyl-3-(4-propan-2-ylphenyl)prop-2-enylidene]amino]-3-nitro-1H-1,2,4-triazole-5-carboxamide

Systemtic Name: N-[[(E)-2-methyl-3-(4-propan-2-ylphenyl)prop-2-enylidene]amino]-3-nitro-1H-1,2,4-triazole-5-carboxamide Openeye Name: N-[[(E)-3-(4-isopropylphenyl)-2-methyl-prop-2-enylidene]amino]-3-nitro-1H-1,2,4-triazole-5-carboxamide CAS Name: N-[[(E)-2-methyl-3-(4-propan-2-ylphenyl)prop-2-enylidene]amino]-3-nitro-1H-1,2,4-triazole-5-carboxamide IUPAC Name: N-[[(E)-2-methyl-3-(4-propan-2-ylphenyl)prop-2-enylidene]amino]-3-nitro-1H-1,2,4-triazole-5-carboxamide Traditional Name: N-[[(E)-2-methyl-3-p-cumenyl-prop-2-enylidene]amino]-3-nitro-1H-1,2,4-triazole-5-carboxamide Formula: C16H18N6O3 MolecularWeight: 342.35252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=C(C)C=NNC(=O)C2=NC(=NN2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C(\C)/C=NNC(=O)C2=NC(=NN2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N6O3/c1-10(2)13-6-4-12(5-7-13)8-11(3)9-17-20-15(23)14-18-16(21-19-14)22(24)25/h4-10H,1-3H3,(H,20,23)(H,18,19,21)/b11-8+,17-9?