4-ethoxy-9-(4-nitrophenyl)-3-(phenylmethyl)pyrimido[1,6-a]pyrimidin-2-one

Systemtic Name: 4-ethoxy-9-(4-nitrophenyl)-3-(phenylmethyl)pyrimido[1,6-a]pyrimidin-2-one Openeye Name: 3-benzyl-4-ethoxy-9-(4-nitrophenyl)pyrimido[1,6-a]pyrimidin-2-one CAS Name: 4-ethoxy-9-(4-nitrophenyl)-3-(phenylmethyl)-2-pyrimido[1,6-a]pyrimidinone IUPAC Name: 3-benzyl-4-ethoxy-9-(4-nitrophenyl)pyrimido[1,6-a]pyrimidin-2-one Traditional Name: 3-benzyl-4-ethoxy-9-(4-nitrophenyl)pyrimido[1,6-a]pyrimidin-2-one Formula: C22H18N4O4 MolecularWeight: 402.40272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=O)N=C2N1C=NC=C2C3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C(=O)N=C2N1C=NC=C2C3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C22H18N4O4/c1-2-30-22-18(12-15-6-4-3-5-7-15)21(27)24-20-19(13-23-14-25(20)22)16-8-10-17(11-9-16)26(28)29/h3-11,13-14H,2,12H2,1H3