ethyl 5-acetyloxy-6-bromanyl-2-(diethylaminomethyl)-1-phenyl-indole-3-carboxylate hydrochloride

Systemtic Name: ethyl 5-acetyloxy-6-bromanyl-2-(diethylaminomethyl)-1-phenyl-indole-3-carboxylate hydrochloride Openeye Name: ethyl 5-acetoxy-6-bromo-2-(diethylaminomethyl)-1-phenyl-indole-3-carboxylate hydrochloride CAS Name: 5-acetyloxy-6-bromo-2-(diethylaminomethyl)-1-phenyl-3-indolecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 5-acetyloxy-6-bromo-2-(diethylaminomethyl)-1-phenylindole-3-carboxylate hydrochloride Traditional Name: 5-acetoxy-6-bromo-2-(diethylaminomethyl)-1-phenyl-indole-3-carboxylic acid ethyl ester hydrochloride Formula: C24H28BrClN2O4 MolecularWeight: 523.84712

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C2=CC(=C(C=C2N1C3=CC=CC=C3)Br)OC(=O)C)C(=O)OCC.Cl

Isomeric SMILES

CCN(CC)CC1=C(C2=CC(=C(C=C2N1C3=CC=CC=C3)Br)OC(=O)C)C(=O)OCC.Cl

InChI

InChI=1S/C24H27BrN2O4.ClH/c1-5-26(6-2)15-21-23(24(29)30-7-3)18-13-22(31-16(4)28)19(25)14-20(18)27(21)17-11-9-8-10-12-17;/h8-14H,5-7,15H2,1-4H3;1H