[2-(diethylamino)-2-oxidanylidene-ethyl] 3-(pyridin-4-ylamino)-1H-indole-2-carboxylate

Systemtic Name: [2-(diethylamino)-2-oxidanylidene-ethyl] 3-(pyridin-4-ylamino)-1H-indole-2-carboxylate Openeye Name: [2-(diethylamino)-2-oxo-ethyl] 3-(4-pyridylamino)-1H-indole-2-carboxylate CAS Name: 3-(pyridin-4-ylamino)-1H-indole-2-carboxylic acid [2-(diethylamino)-2-oxoethyl] ester IUPAC Name: [2-(diethylamino)-2-oxoethyl] 3-(pyridin-4-ylamino)-1H-indole-2-carboxylate Traditional Name: 3-(4-pyridylamino)-1H-indole-2-carboxylic acid [2-(diethylamino)-2-keto-ethyl] ester Formula: C20H22N4O3 MolecularWeight: 366.41368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O3/c1-3-24(4-2)17(25)13-27-20(26)19-18(22-14-9-11-21-12-10-14)15-7-5-6-8-16(15)23-19/h5-12,23H,3-4,13H2,1-2H3,(H,21,22)