1-[4-[methyl(phenyl)amino]-5-nitro-6-[(E)-2-phenylethenyl]pyrimidin-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-[4-[methyl(phenyl)amino]-5-nitro-6-[(E)-2-phenylethenyl]pyrimidin-2-yl]piperidine-4-carboxamide Openeye Name: 1-[4-(N-methylanilino)-5-nitro-6-[(E)-styryl]pyrimidin-2-yl]piperidine-4-carboxamide CAS Name: 1-[4-(N-methylanilino)-5-nitro-6-[(E)-2-phenylethenyl]-2-pyrimidinyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-(N-methylanilino)-5-nitro-6-[(E)-2-phenylethenyl]pyrimidin-2-yl]piperidine-4-carboxamide Traditional Name: 1-[4-(N-methylanilino)-5-nitro-6-[(E)-styryl]pyrimidin-2-yl]isonipecotamide Formula: C25H26N6O3 MolecularWeight: 458.51234

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=NC(=NC(=C2[N+](=O)[O-])C=CC3=CC=CC=C3)N4CCC(CC4)C(=O)N

Isomeric SMILES

CN(C1=CC=CC=C1)C2=NC(=NC(=C2[N+](=O)[O-])/C=C/C3=CC=CC=C3)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C25H26N6O3/c1-29(20-10-6-3-7-11-20)24-22(31(33)34)21(13-12-18-8-4-2-5-9-18)27-25(28-24)30-16-14-19(15-17-30)23(26)32/h2-13,19H,14-17H2,1H3,(H2,26,32)/b13-12+