1-(3,3-dimethyl-2-oxidanylidene-butyl)indole-2-carboxylate

Systemtic Name: 1-(3,3-dimethyl-2-oxidanylidene-butyl)indole-2-carboxylate Openeye Name: 1-(3,3-dimethyl-2-oxo-butyl)indole-2-carboxylate CAS Name: 1-(3,3-dimethyl-2-oxobutyl)-2-indolecarboxylate IUPAC Name: 1-(3,3-dimethyl-2-oxobutyl)indole-2-carboxylate Traditional Name: 1-(2-keto-3,3-dimethyl-butyl)indole-2-carboxylate Formula: C15H16NO3- MolecularWeight: 258.29244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C2=CC=CC=C2C=C1C(=O)[O-]

Isomeric SMILES

CC(C)(C)C(=O)CN1C2=CC=CC=C2C=C1C(=O)[O-]

InChI

InChI=1S/C15H17NO3/c1-15(2,3)13(17)9-16-11-7-5-4-6-10(11)8-12(16)14(18)19/h4-8H,9H2,1-3H3,(H,18,19)/p-1