tert-butyl 4-methanoyl-3-(1H-pyrazol-5-yl)indole-1-carboxylate

Systemtic Name: tert-butyl 4-methanoyl-3-(1H-pyrazol-5-yl)indole-1-carboxylate Openeye Name: tert-butyl 4-formyl-3-(1H-pyrazol-5-yl)indole-1-carboxylate CAS Name: 4-formyl-3-(1H-pyrazol-5-yl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-formyl-3-(1H-pyrazol-5-yl)indole-1-carboxylate Traditional Name: 4-formyl-3-(1H-pyrazol-5-yl)indole-1-carboxylic acid tert-butyl ester Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C(C=CC=C21)C=O)C3=CC=NN3

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C(C=CC=C21)C=O)C3=CC=NN3

InChI

InChI=1S/C17H17N3O3/c1-17(2,3)23-16(22)20-9-12(13-7-8-18-19-13)15-11(10-21)5-4-6-14(15)20/h4-10H,1-3H3,(H,18,19)