tert-butyl 2-(4-chlorophenyl)carbonyl-6-methyl-3-propanoyloxy-indole-1-carboxylate

Systemtic Name: tert-butyl 2-(4-chlorophenyl)carbonyl-6-methyl-3-propanoyloxy-indole-1-carboxylate Openeye Name: tert-butyl 2-(4-chlorobenzoyl)-6-methyl-3-propanoyloxy-indole-1-carboxylate CAS Name: 2-[(4-chlorophenyl)-oxomethyl]-6-methyl-3-(1-oxopropoxy)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-chlorobenzoyl)-6-methyl-3-propanoyloxyindole-1-carboxylate Traditional Name: 2-(4-chlorobenzoyl)-6-methyl-3-propionyloxy-indole-1-carboxylic acid tert-butyl ester Formula: C24H24ClNO5 MolecularWeight: 441.90406

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(N(C2=C1C=CC(=C2)C)C(=O)OC(C)(C)C)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCC(=O)OC1=C(N(C2=C1C=CC(=C2)C)C(=O)OC(C)(C)C)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H24ClNO5/c1-6-19(27)30-22-17-12-7-14(2)13-18(17)26(23(29)31-24(3,4)5)20(22)21(28)15-8-10-16(25)11-9-15/h7-13H,6H2,1-5H3