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

Systemtic Name: ethyl 2-[3-(acetyloxymethyl)furan-2-yl]carbonyl-6-chloranyl-3-(2-methylpropanoylamino)indole-1-carboxylate Openeye Name: ethyl 2-[3-(acetoxymethyl)furan-2-carbonyl]-6-chloro-3-(2-methylpropanoylamino)indole-1-carboxylate CAS Name: 2-[[3-(acetyloxymethyl)-2-furanyl]-oxomethyl]-6-chloro-3-[(2-methyl-1-oxopropyl)amino]-1-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(acetyloxymethyl)furan-2-carbonyl]-6-chloro-3-(2-methylpropanoylamino)indole-1-carboxylate Traditional Name: 2-[3-(acetoxymethyl)-2-furoyl]-6-chloro-3-(isobutyrylamino)indole-1-carboxylic acid ethyl ester Formula: C23H23ClN2O7 MolecularWeight: 474.89092

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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(C)C

Isomeric SMILES

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

InChI

InChI=1S/C23H23ClN2O7/c1-5-31-23(30)26-17-10-15(24)6-7-16(17)18(25-22(29)12(2)3)19(26)20(28)21-14(8-9-32-21)11-33-13(4)27/h6-10,12H,5,11H2,1-4H3,(H,25,29)