[(2S)-1-methoxy-1-oxidanylidene-propan-2-yl] 3-(pyridin-4-ylamino)-1H-indole-2-carboxylate

Systemtic Name: [(2S)-1-methoxy-1-oxidanylidene-propan-2-yl] 3-(pyridin-4-ylamino)-1H-indole-2-carboxylate Openeye Name: [(1S)-2-methoxy-1-methyl-2-oxo-ethyl] 3-(4-pyridylamino)-1H-indole-2-carboxylate CAS Name: 3-(pyridin-4-ylamino)-1H-indole-2-carboxylic acid [(2S)-1-methoxy-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-methoxy-1-oxopropan-2-yl] 3-(pyridin-4-ylamino)-1H-indole-2-carboxylate Traditional Name: 3-(4-pyridylamino)-1H-indole-2-carboxylic acid [(1S)-2-keto-2-methoxy-1-methyl-ethyl] ester Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC(=O)C1=C(C2=CC=CC=C2N1)NC3=CC=NC=C3

Isomeric SMILES

C[C@@H](C(=O)OC)OC(=O)C1=C(C2=CC=CC=C2N1)NC3=CC=NC=C3

InChI

InChI=1S/C18H17N3O4/c1-11(17(22)24-2)25-18(23)16-15(20-12-7-9-19-10-8-12)13-5-3-4-6-14(13)21-16/h3-11,21H,1-2H3,(H,19,20)/t11-/m0/s1