methyl 2-[3-[2-cyano-3-[(4-fluorophenyl)amino]-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethanoate

Systemtic Name: methyl 2-[3-[2-cyano-3-[(4-fluorophenyl)amino]-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethanoate Openeye Name: methyl 2-[3-[2-cyano-3-(4-fluoroanilino)-3-oxo-prop-1-enyl]indol-1-yl]acetate CAS Name: 2-[3-[2-cyano-3-(4-fluoroanilino)-3-oxoprop-1-enyl]-1-indolyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[2-cyano-3-(4-fluoroanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate Traditional Name: 2-[3-[2-cyano-3-(4-fluoroanilino)-3-keto-prop-1-enyl]indol-1-yl]acetic acid methyl ester Formula: C21H16FN3O3 MolecularWeight: 377.368443

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C=C(C2=CC=CC=C21)C=C(C#N)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)CN1C=C(C2=CC=CC=C21)C=C(C#N)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H16FN3O3/c1-28-20(26)13-25-12-15(18-4-2-3-5-19(18)25)10-14(11-23)21(27)24-17-8-6-16(22)7-9-17/h2-10,12H,13H2,1H3,(H,24,27)