3-[(2-methyl-3-nitro-phenyl)methyl]-[1]benzofuro[3,2-d]pyrimidin-4-one

Systemtic Name: 3-[(2-methyl-3-nitro-phenyl)methyl]-[1]benzofuro[3,2-d]pyrimidin-4-one Openeye Name: 3-[(2-methyl-3-nitro-phenyl)methyl]benzofuro[3,2-d]pyrimidin-4-one CAS Name: 3-[(2-methyl-3-nitrophenyl)methyl]-4-benzofuro[3,2-d]pyrimidinone IUPAC Name: 3-[(2-methyl-3-nitrophenyl)methyl]-[1]benzofuro[3,2-d]pyrimidin-4-one Traditional Name: 3-(2-methyl-3-nitro-benzyl)benzofuro[3,2-d]pyrimidin-4-one Formula: C18H13N3O4 MolecularWeight: 335.31352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CN2C=NC3=C(C2=O)OC4=CC=CC=C43

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CN2C=NC3=C(C2=O)OC4=CC=CC=C43

InChI

InChI=1S/C18H13N3O4/c1-11-12(5-4-7-14(11)21(23)24)9-20-10-19-16-13-6-2-3-8-15(13)25-17(16)18(20)22/h2-8,10H,9H2,1H3