(2S)-1-(1-methylpyrazol-4-yl)carbonyl-2,3-dihydroindole-2-carboxylate

Systemtic Name: (2S)-1-(1-methylpyrazol-4-yl)carbonyl-2,3-dihydroindole-2-carboxylate Openeye Name: (2S)-1-(1-methylpyrazole-4-carbonyl)indoline-2-carboxylate CAS Name: (2S)-1-[(1-methyl-4-pyrazolyl)-oxomethyl]-2,3-dihydroindole-2-carboxylate IUPAC Name: (2S)-1-(1-methylpyrazole-4-carbonyl)-2,3-dihydroindole-2-carboxylate Traditional Name: (2S)-1-(1-methylpyrazole-4-carbonyl)indoline-2-carboxylate Formula: C14H12N3O3- MolecularWeight: 270.26338

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)N2C(CC3=CC=CC=C32)C(=O)[O-]

Isomeric SMILES

CN1C=C(C=N1)C(=O)N2[C@@H](CC3=CC=CC=C32)C(=O)[O-]

InChI

InChI=1S/C14H13N3O3/c1-16-8-10(7-15-16)13(18)17-11-5-3-2-4-9(11)6-12(17)14(19)20/h2-5,7-8,12H,6H2,1H3,(H,19,20)/p-1/t12-/m0/s1