ethyl N-[(E)-1-[(7-fluoranyl-3-oxidanylidene-4-prop-2-enyl-1,4-benzoxazin-6-yl)amino]-1-oxidanylidene-pent-2-en-3-yl]carbamate

Systemtic Name: ethyl N-[(E)-1-[(7-fluoranyl-3-oxidanylidene-4-prop-2-enyl-1,4-benzoxazin-6-yl)amino]-1-oxidanylidene-pent-2-en-3-yl]carbamate Openeye Name: ethyl N-[(E)-3-[(4-allyl-7-fluoro-3-oxo-1,4-benzoxazin-6-yl)amino]-1-ethyl-3-oxo-prop-1-enyl]carbamate CAS Name: N-[(E)-1-[(7-fluoro-3-oxo-4-prop-2-enyl-1,4-benzoxazin-6-yl)amino]-1-oxopent-2-en-3-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[(E)-1-[(7-fluoro-3-oxo-4-prop-2-enyl-1,4-benzoxazin-6-yl)amino]-1-oxopent-2-en-3-yl]carbamate Traditional Name: N-[(E)-3-[(4-allyl-7-fluoro-3-keto-1,4-benzoxazin-6-yl)amino]-1-ethyl-3-keto-prop-1-enyl]carbamic acid ethyl ester Formula: C19H22FN3O5 MolecularWeight: 391.393483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC(=O)NC1=C(C=C2C(=C1)N(C(=O)CO2)CC=C)F)NC(=O)OCC

Isomeric SMILES

CC/C(=C\C(=O)NC1=C(C=C2C(=C1)N(C(=O)CO2)CC=C)F)/NC(=O)OCC

InChI

InChI=1S/C19H22FN3O5/c1-4-7-23-15-10-14(13(20)9-16(15)28-11-18(23)25)22-17(24)8-12(5-2)21-19(26)27-6-3/h4,8-10H,1,5-7,11H2,2-3H3,(H,21,26)(H,22,24)/b12-8+