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

Systemtic Name: 3-[(3-chloranyl-5-ethoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-1H-quinazoline-2,4-dione Openeye Name: 3-[(3-chloro-5-ethoxy-4-prop-2-ynoxy-phenyl)methyleneamino]-1H-quinazoline-2,4-dione CAS Name: 3-[(3-chloro-5-ethoxy-4-prop-2-ynoxyphenyl)methylideneamino]-1H-quinazoline-2,4-dione IUPAC Name: 3-[(3-chloro-5-ethoxy-4-prop-2-ynoxyphenyl)methylideneamino]-1H-quinazoline-2,4-dione Traditional Name: 3-[(3-chloro-5-ethoxy-4-propargyloxy-benzylidene)amino]-1H-quinazoline-2,4-quinone Formula: C20H16ClN3O4 MolecularWeight: 397.81174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NN2C(=O)C3=CC=CC=C3NC2=O)Cl)OCC#C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=NN2C(=O)C3=CC=CC=C3NC2=O)Cl)OCC#C

InChI

InChI=1S/C20H16ClN3O4/c1-3-9-28-18-15(21)10-13(11-17(18)27-4-2)12-22-24-19(25)14-7-5-6-8-16(14)23-20(24)26/h1,5-8,10-12H,4,9H2,2H3,(H,23,26)