[4-[2-azanyl-6-[(4-methoxyphenyl)methyl]pyrimidin-4-yl]piperidin-1-yl]-(4-nitrophenyl)methanone

Systemtic Name: [4-[2-azanyl-6-[(4-methoxyphenyl)methyl]pyrimidin-4-yl]piperidin-1-yl]-(4-nitrophenyl)methanone Openeye Name: [4-[2-amino-6-[(4-methoxyphenyl)methyl]pyrimidin-4-yl]-1-piperidyl]-(4-nitrophenyl)methanone CAS Name: [4-[2-amino-6-[(4-methoxyphenyl)methyl]-4-pyrimidinyl]-1-piperidinyl]-(4-nitrophenyl)methanone IUPAC Name: [4-[2-amino-6-[(4-methoxyphenyl)methyl]pyrimidin-4-yl]piperidin-1-yl]-(4-nitrophenyl)methanone Traditional Name: [4-(2-amino-6-p-anisyl-pyrimidin-4-yl)piperidino]-(4-nitrophenyl)methanone Formula: C24H25N5O4 MolecularWeight: 447.4864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NC(=NC(=C2)C3CCN(CC3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])N

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NC(=NC(=C2)C3CCN(CC3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])N

InChI

InChI=1S/C24H25N5O4/c1-33-21-8-2-16(3-9-21)14-19-15-22(27-24(25)26-19)17-10-12-28(13-11-17)23(30)18-4-6-20(7-5-18)29(31)32/h2-9,15,17H,10-14H2,1H3,(H2,25,26,27)