ethyl 6-bromanyl-1-butyl-5-(2-diazanyl-2-oxidanylidene-ethoxy)-2-(morpholin-4-ylmethyl)indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-1-butyl-5-(2-diazanyl-2-oxidanylidene-ethoxy)-2-(morpholin-4-ylmethyl)indole-3-carboxylate Openeye Name: ethyl 6-bromo-1-butyl-5-(2-hydrazino-2-oxo-ethoxy)-2-(morpholinomethyl)indole-3-carboxylate CAS Name: 6-bromo-1-butyl-5-(2-hydrazinyl-2-oxoethoxy)-2-(4-morpholinylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-1-butyl-5-(2-hydrazinyl-2-oxoethoxy)-2-(morpholin-4-ylmethyl)indole-3-carboxylate Traditional Name: 6-bromo-1-butyl-5-(2-hydrazino-2-keto-ethoxy)-2-(morpholinomethyl)indole-3-carboxylic acid ethyl ester Formula: C22H31BrN4O5 MolecularWeight: 511.40934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC(=C(C=C2C(=C1CN3CCOCC3)C(=O)OCC)OCC(=O)NN)Br

Isomeric SMILES

CCCCN1C2=CC(=C(C=C2C(=C1CN3CCOCC3)C(=O)OCC)OCC(=O)NN)Br

InChI

InChI=1S/C22H31BrN4O5/c1-3-5-6-27-17-12-16(23)19(32-14-20(28)25-24)11-15(17)21(22(29)31-4-2)18(27)13-26-7-9-30-10-8-26/h11-12H,3-10,13-14,24H2,1-2H3,(H,25,28)