ethyl 6-chloranyl-1-[2-(diethylamino)-2-oxidanylidene-ethyl]-3-(pyridin-4-ylamino)indole-2-carboxylate

Systemtic Name: ethyl 6-chloranyl-1-[2-(diethylamino)-2-oxidanylidene-ethyl]-3-(pyridin-4-ylamino)indole-2-carboxylate Openeye Name: ethyl 6-chloro-1-[2-(diethylamino)-2-oxo-ethyl]-3-(4-pyridylamino)indole-2-carboxylate CAS Name: 6-chloro-1-[2-(diethylamino)-2-oxoethyl]-3-(pyridin-4-ylamino)-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-1-[2-(diethylamino)-2-oxoethyl]-3-(pyridin-4-ylamino)indole-2-carboxylate Traditional Name: 6-chloro-1-[2-(diethylamino)-2-keto-ethyl]-3-(4-pyridylamino)indole-2-carboxylic acid ethyl ester Formula: C22H25ClN4O3 MolecularWeight: 428.9119

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN1C2=C(C=CC(=C2)Cl)C(=C1C(=O)OCC)NC3=CC=NC=C3

Isomeric SMILES

CCN(CC)C(=O)CN1C2=C(C=CC(=C2)Cl)C(=C1C(=O)OCC)NC3=CC=NC=C3

InChI

InChI=1S/C22H25ClN4O3/c1-4-26(5-2)19(28)14-27-18-13-15(23)7-8-17(18)20(21(27)22(29)30-6-3)25-16-9-11-24-12-10-16/h7-13H,4-6,14H2,1-3H3,(H,24,25)