ethyl 3-acetamido-2-[3-(acetyloxymethyl)furan-2-yl]carbonyl-6-chloranyl-indole-1-carboxylate

Systemtic Name: ethyl 3-acetamido-2-[3-(acetyloxymethyl)furan-2-yl]carbonyl-6-chloranyl-indole-1-carboxylate Openeye Name: ethyl 3-acetamido-2-[3-(acetoxymethyl)furan-2-carbonyl]-6-chloro-indole-1-carboxylate CAS Name: 3-acetamido-2-[[3-(acetyloxymethyl)-2-furanyl]-oxomethyl]-6-chloro-1-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-acetamido-2-[3-(acetyloxymethyl)furan-2-carbonyl]-6-chloroindole-1-carboxylate Traditional Name: 3-acetamido-2-[3-(acetoxymethyl)-2-furoyl]-6-chloro-indole-1-carboxylic acid ethyl ester Formula: C21H19ClN2O7 MolecularWeight: 446.83776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=C(C=CC(=C2)Cl)C(=C1C(=O)C3=C(C=CO3)COC(=O)C)NC(=O)C

Isomeric SMILES

CCOC(=O)N1C2=C(C=CC(=C2)Cl)C(=C1C(=O)C3=C(C=CO3)COC(=O)C)NC(=O)C

InChI

InChI=1S/C21H19ClN2O7/c1-4-29-21(28)24-16-9-14(22)5-6-15(16)17(23-11(2)25)18(24)19(27)20-13(7-8-30-20)10-31-12(3)26/h5-9H,4,10H2,1-3H3,(H,23,25)