7-(2,4-diethoxyphenyl)-8-methoxy-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one

Systemtic Name: 7-(2,4-diethoxyphenyl)-8-methoxy-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one Openeye Name: 7-(2,4-diethoxyphenyl)-8-methoxy-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one CAS Name: 7-(2,4-diethoxyphenyl)-8-methoxy-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one IUPAC Name: 7-(2,4-diethoxyphenyl)-8-methoxy-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one Traditional Name: 7-(2,4-diethoxyphenyl)-8-methoxy-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C2=NCC3=NC(=O)C=CN3C4=C2C(=CC=C4)OC)OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1)C2=NCC3=NC(=O)C=CN3C4=C2C(=CC=C4)OC)OCC

InChI

InChI=1S/C23H23N3O4/c1-4-29-15-9-10-16(19(13-15)30-5-2)23-22-17(7-6-8-18(22)28-3)26-12-11-21(27)25-20(26)14-24-23/h6-13H,4-5,14H2,1-3H3