ethyl 5-acetyloxy-6-bromanyl-2-(dimethylaminomethyl)-1-(4-methylphenyl)indole-3-carboxylate hydrochloride

Systemtic Name: ethyl 5-acetyloxy-6-bromanyl-2-(dimethylaminomethyl)-1-(4-methylphenyl)indole-3-carboxylate hydrochloride Openeye Name: ethyl 5-acetoxy-6-bromo-2-(dimethylaminomethyl)-1-(p-tolyl)indole-3-carboxylate hydrochloride CAS Name: 5-acetyloxy-6-bromo-2-(dimethylaminomethyl)-1-(4-methylphenyl)-3-indolecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 5-acetyloxy-6-bromo-2-(dimethylaminomethyl)-1-(4-methylphenyl)indole-3-carboxylate hydrochloride Traditional Name: 5-acetoxy-6-bromo-2-(dimethylaminomethyl)-1-(p-tolyl)indole-3-carboxylic acid ethyl ester hydrochloride Formula: C23H26BrClN2O4 MolecularWeight: 509.82054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C3=CC=C(C=C3)C)CN(C)C.Cl

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C3=CC=C(C=C3)C)CN(C)C.Cl

InChI

InChI=1S/C23H25BrN2O4.ClH/c1-6-29-23(28)22-17-11-21(30-15(3)27)18(24)12-19(17)26(20(22)13-25(4)5)16-9-7-14(2)8-10-16;/h7-12H,6,13H2,1-5H3;1H