3-[(3,5-dimethoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[(3,5-dimethoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-1H-quinazoline-2,4-dione Openeye Name: 3-[(3,5-dimethoxy-4-prop-2-ynoxy-phenyl)methyleneamino]-1H-quinazoline-2,4-dione CAS Name: 3-[(3,5-dimethoxy-4-prop-2-ynoxyphenyl)methylideneamino]-1H-quinazoline-2,4-dione IUPAC Name: 3-[(3,5-dimethoxy-4-prop-2-ynoxyphenyl)methylideneamino]-1H-quinazoline-2,4-dione Traditional Name: 3-[(3,5-dimethoxy-4-propargyloxy-benzylidene)amino]-1H-quinazoline-2,4-quinone Formula: C20H17N3O5 MolecularWeight: 379.36608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC#C)OC)C=NN2C(=O)C3=CC=CC=C3NC2=O

Isomeric SMILES

COC1=CC(=CC(=C1OCC#C)OC)C=NN2C(=O)C3=CC=CC=C3NC2=O

InChI

InChI=1S/C20H17N3O5/c1-4-9-28-18-16(26-2)10-13(11-17(18)27-3)12-21-23-19(24)14-7-5-6-8-15(14)22-20(23)25/h1,5-8,10-12H,9H2,2-3H3,(H,22,25)