2-(2,2-dimethylpropoxycarbonyl)-5-(2-oxidanylidenepropyl)indole-1-carboxylate

Systemtic Name: 2-(2,2-dimethylpropoxycarbonyl)-5-(2-oxidanylidenepropyl)indole-1-carboxylate Openeye Name: 5-acetonyl-2-(2,2-dimethylpropoxycarbonyl)indole-1-carboxylate CAS Name: 2-[2,2-dimethylpropoxy(oxo)methyl]-5-(2-oxopropyl)-1-indolecarboxylate IUPAC Name: 2-(2,2-dimethylpropoxycarbonyl)-5-(2-oxopropyl)indole-1-carboxylate Traditional Name: 5-acetonyl-2-neopentyloxycarbonyl-indole-1-carboxylate Formula: C18H20NO5- MolecularWeight: 330.3551

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=CC2=C(C=C1)N(C(=C2)C(=O)OCC(C)(C)C)C(=O)[O-]

Isomeric SMILES

CC(=O)CC1=CC2=C(C=C1)N(C(=C2)C(=O)OCC(C)(C)C)C(=O)[O-]

InChI

InChI=1S/C18H21NO5/c1-11(20)7-12-5-6-14-13(8-12)9-15(19(14)17(22)23)16(21)24-10-18(2,3)4/h5-6,8-9H,7,10H2,1-4H3,(H,22,23)/p-1