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

Systemtic Name: ethyl 6-bromanyl-1-butyl-5-methoxy-2-(morpholin-4-ylmethyl)indole-3-carboxylate Openeye Name: ethyl 6-bromo-1-butyl-5-methoxy-2-(morpholinomethyl)indole-3-carboxylate CAS Name: 6-bromo-1-butyl-5-methoxy-2-(4-morpholinylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-1-butyl-5-methoxy-2-(morpholin-4-ylmethyl)indole-3-carboxylate Traditional Name: 6-bromo-1-butyl-5-methoxy-2-(morpholinomethyl)indole-3-carboxylic acid ethyl ester Formula: C21H29BrN2O4 MolecularWeight: 453.36996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29BrN2O4/c1-4-6-7-24-17-13-16(22)19(26-3)12-15(17)20(21(25)28-5-2)18(24)14-23-8-10-27-11-9-23/h12-13H,4-11,14H2,1-3H3