[2,2-bis(fluoranyl)-3-(phenylmethoxycarbonylaminomethyl)cyclopropyl]methyl anthracene-9-carboxylate

Systemtic Name: [2,2-bis(fluoranyl)-3-(phenylmethoxycarbonylaminomethyl)cyclopropyl]methyl anthracene-9-carboxylate Openeye Name: [3-(benzyloxycarbonylaminomethyl)-2,2-difluoro-cyclopropyl]methyl anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid [2,2-difluoro-3-(phenylmethoxycarbonylaminomethyl)cyclopropyl]methyl ester IUPAC Name: [2,2-difluoro-3-(phenylmethoxycarbonylaminomethyl)cyclopropyl]methyl anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid [3-(benzyloxycarbonylaminomethyl)-2,2-difluoro-cyclopropyl]methyl ester Formula: C28H23F2NO4 MolecularWeight: 475.483326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC2C(C2(F)F)COC(=O)C3=C4C=CC=CC4=CC5=CC=CC=C53

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC2C(C2(F)F)COC(=O)C3=C4C=CC=CC4=CC5=CC=CC=C53

InChI

InChI=1S/C28H23F2NO4/c29-28(30)23(15-31-27(33)35-16-18-8-2-1-3-9-18)24(28)17-34-26(32)25-21-12-6-4-10-19(21)14-20-11-5-7-13-22(20)25/h1-14,23-24H,15-17H2,(H,31,33)