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

Systemtic Name: [4-[2-azanyl-6-[(4-methoxyphenyl)methyl]pyrimidin-4-yl]piperidin-1-yl]-(2-nitrophenyl)methanone Openeye Name: [4-[2-amino-6-[(4-methoxyphenyl)methyl]pyrimidin-4-yl]-1-piperidyl]-(2-nitrophenyl)methanone CAS Name: [4-[2-amino-6-[(4-methoxyphenyl)methyl]-4-pyrimidinyl]-1-piperidinyl]-(2-nitrophenyl)methanone IUPAC Name: [4-[2-amino-6-[(4-methoxyphenyl)methyl]pyrimidin-4-yl]piperidin-1-yl]-(2-nitrophenyl)methanone Traditional Name: [4-(2-amino-6-p-anisyl-pyrimidin-4-yl)piperidino]-(2-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=CC=C4[N+](=O)[O-])N

Isomeric SMILES

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

InChI

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