ethyl 6-[[1-(2,2-dimethylpropanoyloxy)-2-oxidanyl-3-propanoyl-indol-6-yl]carbamoylamino]hexanoate

Systemtic Name: ethyl 6-[[1-(2,2-dimethylpropanoyloxy)-2-oxidanyl-3-propanoyl-indol-6-yl]carbamoylamino]hexanoate Openeye Name: ethyl 6-[[1-(2,2-dimethylpropanoyloxy)-2-hydroxy-3-propanoyl-indol-6-yl]carbamoylamino]hexanoate CAS Name: 6-[[[[1-(2,2-dimethyl-1-oxopropoxy)-2-hydroxy-3-(1-oxopropyl)-6-indolyl]amino]-oxomethyl]amino]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[[1-(2,2-dimethylpropanoyloxy)-2-hydroxy-3-propanoylindol-6-yl]carbamoylamino]hexanoate Traditional Name: 6-[(2-hydroxy-1-pivaloyloxy-3-propionyl-indol-6-yl)carbamoylamino]hexanoic acid ethyl ester Formula: C25H35N3O7 MolecularWeight: 489.5613

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(N(C2=C1C=CC(=C2)NC(=O)NCCCCCC(=O)OCC)OC(=O)C(C)(C)C)O

Isomeric SMILES

CCC(=O)C1=C(N(C2=C1C=CC(=C2)NC(=O)NCCCCCC(=O)OCC)OC(=O)C(C)(C)C)O

InChI

InChI=1S/C25H35N3O7/c1-6-19(29)21-17-13-12-16(15-18(17)28(22(21)31)35-23(32)25(3,4)5)27-24(33)26-14-10-8-9-11-20(30)34-7-2/h12-13,15,31H,6-11,14H2,1-5H3,(H2,26,27,33)