5-ethanoyl-6-(3-methoxy-2-nitro-4-oxidanyl-phenyl)-3-phenethyl-4-phenyl-1,6-dihydropyrimidin-2-one

Systemtic Name: 5-ethanoyl-6-(3-methoxy-2-nitro-4-oxidanyl-phenyl)-3-phenethyl-4-phenyl-1,6-dihydropyrimidin-2-one Openeye Name: 5-acetyl-6-(4-hydroxy-3-methoxy-2-nitro-phenyl)-3-phenethyl-4-phenyl-1,6-dihydropyrimidin-2-one CAS Name: 5-acetyl-6-(4-hydroxy-3-methoxy-2-nitrophenyl)-3-phenethyl-4-phenyl-1,6-dihydropyrimidin-2-one IUPAC Name: 5-acetyl-6-(4-hydroxy-3-methoxy-2-nitrophenyl)-3-phenethyl-4-phenyl-1,6-dihydropyrimidin-2-one Traditional Name: 5-acetyl-6-(4-hydroxy-3-methoxy-2-nitro-phenyl)-3-phenethyl-4-phenyl-1,6-dihydropyrimidin-2-one Formula: C27H25N3O6 MolecularWeight: 487.5039

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C(=O)NC1C2=C(C(=C(C=C2)O)OC)[N+](=O)[O-])CCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=C(N(C(=O)NC1C2=C(C(=C(C=C2)O)OC)[N+](=O)[O-])CCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25N3O6/c1-17(31)22-23(20-13-14-21(32)26(36-2)25(20)30(34)35)28-27(33)29(16-15-18-9-5-3-6-10-18)24(22)19-11-7-4-8-12-19/h3-14,23,32H,15-16H2,1-2H3,(H,28,33)