1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl (E)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]prop-2-enoate

Systemtic Name: 1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl (E)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]prop-2-enoate Openeye Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl (E)-3-[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]-2-propenoic acid 1-(4-oxo-1H-quinazolin-2-yl)ethyl ester IUPAC Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl (E)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[4-(2-amino-2-keto-ethoxy)-3-methoxy-phenyl]acrylic acid 1-(4-keto-1H-quinazolin-2-yl)ethyl ester Formula: C22H21N3O6 MolecularWeight: 423.41864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C=CC3=CC(=C(C=C3)OCC(=O)N)OC

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)/C=C/C3=CC(=C(C=C3)OCC(=O)N)OC

InChI

InChI=1S/C22H21N3O6/c1-13(21-24-16-6-4-3-5-15(16)22(28)25-21)31-20(27)10-8-14-7-9-17(18(11-14)29-2)30-12-19(23)26/h3-11,13H,12H2,1-2H3,(H2,23,26)(H,24,25,28)/b10-8+