4-methyl-3-[(3-nitrophenyl)methyl]-7-pyrimidin-2-yloxy-chromen-2-one

Systemtic Name: 4-methyl-3-[(3-nitrophenyl)methyl]-7-pyrimidin-2-yloxy-chromen-2-one Openeye Name: 4-methyl-3-[(3-nitrophenyl)methyl]-7-pyrimidin-2-yloxy-chromen-2-one CAS Name: 4-methyl-3-[(3-nitrophenyl)methyl]-7-(2-pyrimidinyloxy)-1-benzopyran-2-one IUPAC Name: 4-methyl-3-[(3-nitrophenyl)methyl]-7-pyrimidin-2-yloxychromen-2-one Traditional Name: 4-methyl-3-(3-nitrobenzyl)-7-(2-pyrimidyloxy)coumarin Formula: C21H15N3O5 MolecularWeight: 389.3609

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC3=NC=CC=N3)CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC3=NC=CC=N3)CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O5/c1-13-17-7-6-16(28-21-22-8-3-9-23-21)12-19(17)29-20(25)18(13)11-14-4-2-5-15(10-14)24(26)27/h2-10,12H,11H2,1H3