ethyl (E)-5-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3-oxidanylidene-pent-4-enoate

Systemtic Name: ethyl (E)-5-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3-oxidanylidene-pent-4-enoate Openeye Name: ethyl (E)-5-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolyl]-3-oxo-pent-4-enoate CAS Name: (E)-5-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-3-oxo-4-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-5-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3-oxopent-4-enoate Traditional Name: (E)-5-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolyl]-3-keto-pent-4-enoic acid ethyl ester Formula: C25H22FNO3 MolecularWeight: 403.445483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)C=CC1=C(C2=CC=CC=C2N=C1C3CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)CC(=O)/C=C/C1=C(C2=CC=CC=C2N=C1C3CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H22FNO3/c1-2-30-23(29)15-19(28)13-14-21-24(16-9-11-18(26)12-10-16)20-5-3-4-6-22(20)27-25(21)17-7-8-17/h3-6,9-14,17H,2,7-8,15H2,1H3/b14-13+