ethyl (E)-3-[4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[(6,7-dimethoxy-4-quinazolinyl)amino]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl]acrylic acid ethyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC=C(C=C1)NC2=NC=NC3=CC(=C(C=C32)OC)OC

Isomeric SMILES

CCOC(=O)/C=C/C1=CC=C(C=C1)NC2=NC=NC3=CC(=C(C=C32)OC)OC

InChI

InChI=1S/C21H21N3O4/c1-4-28-20(25)10-7-14-5-8-15(9-6-14)24-21-16-11-18(26-2)19(27-3)12-17(16)22-13-23-21/h5-13H,4H2,1-3H3,(H,22,23,24)/b10-7+