tert-butyl 5-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-3-(3-fluorophenyl)indazole-1-carboxylate

Systemtic Name: tert-butyl 5-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-3-(3-fluorophenyl)indazole-1-carboxylate Openeye Name: tert-butyl 5-[(E)-3-ethoxy-3-oxo-prop-1-enyl]-3-(3-fluorophenyl)indazole-1-carboxylate CAS Name: 5-[(E)-3-ethoxy-3-oxoprop-1-enyl]-3-(3-fluorophenyl)-1-indazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[(E)-3-ethoxy-3-oxoprop-1-enyl]-3-(3-fluorophenyl)indazole-1-carboxylate Traditional Name: 5-[(E)-3-ethoxy-3-keto-prop-1-enyl]-3-(3-fluorophenyl)indazole-1-carboxylic acid tert-butyl ester Formula: C23H23FN2O4 MolecularWeight: 410.438123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC2=C(C=C1)N(N=C2C3=CC(=CC=C3)F)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)/C=C/C1=CC2=C(C=C1)N(N=C2C3=CC(=CC=C3)F)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H23FN2O4/c1-5-29-20(27)12-10-15-9-11-19-18(13-15)21(16-7-6-8-17(24)14-16)25-26(19)22(28)30-23(2,3)4/h6-14H,5H2,1-4H3/b12-10+