methyl 1-[5-(acetyloxymethyl)furan-2-yl]-7-fluoranyl-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: methyl 1-[5-(acetyloxymethyl)furan-2-yl]-7-fluoranyl-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: methyl 1-[5-(acetoxymethyl)-2-furyl]-7-fluoro-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 1-[5-(acetyloxymethyl)-2-furanyl]-7-fluoro-9H-pyrido[3,4-b]indole-3-carboxylic acid methyl ester IUPAC Name: methyl 1-[5-(acetyloxymethyl)furan-2-yl]-7-fluoro-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 1-[5-(acetoxymethyl)-2-furyl]-7-fluoro-9H-$b-carboline-3-carboxylic acid methyl ester Formula: C20H15FN2O5 MolecularWeight: 382.341903

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=CC=C(O1)C2=C3C(=CC(=N2)C(=O)OC)C4=C(N3)C=C(C=C4)F

Isomeric SMILES

CC(=O)OCC1=CC=C(O1)C2=C3C(=CC(=N2)C(=O)OC)C4=C(N3)C=C(C=C4)F

InChI

InChI=1S/C20H15FN2O5/c1-10(24)27-9-12-4-6-17(28-12)19-18-14(8-16(23-19)20(25)26-2)13-5-3-11(21)7-15(13)22-18/h3-8,22H,9H2,1-2H3