methyl 4-[[1-(2,2-dimethylpropanoyloxy)-2-oxidanyl-3-propanoyl-indol-6-yl]carbamoylamino]benzoate

Systemtic Name: methyl 4-[[1-(2,2-dimethylpropanoyloxy)-2-oxidanyl-3-propanoyl-indol-6-yl]carbamoylamino]benzoate Openeye Name: methyl 4-[[1-(2,2-dimethylpropanoyloxy)-2-hydroxy-3-propanoyl-indol-6-yl]carbamoylamino]benzoate CAS Name: 4-[[[[1-(2,2-dimethyl-1-oxopropoxy)-2-hydroxy-3-(1-oxopropyl)-6-indolyl]amino]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(2,2-dimethylpropanoyloxy)-2-hydroxy-3-propanoylindol-6-yl]carbamoylamino]benzoate Traditional Name: 4-[(2-hydroxy-1-pivaloyloxy-3-propionyl-indol-6-yl)carbamoylamino]benzoic acid methyl ester Formula: C25H27N3O7 MolecularWeight: 481.49778

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(N(C2=C1C=CC(=C2)NC(=O)NC3=CC=C(C=C3)C(=O)OC)OC(=O)C(C)(C)C)O

Isomeric SMILES

CCC(=O)C1=C(N(C2=C1C=CC(=C2)NC(=O)NC3=CC=C(C=C3)C(=O)OC)OC(=O)C(C)(C)C)O

InChI

InChI=1S/C25H27N3O7/c1-6-19(29)20-17-12-11-16(13-18(17)28(21(20)30)35-23(32)25(2,3)4)27-24(33)26-15-9-7-14(8-10-15)22(31)34-5/h7-13,30H,6H2,1-5H3,(H2,26,27,33)