ethyl 2-methyl-1-(4-methylphenyl)-5-[3-(4-methylpiperazin-1-yl)-2-oxidanyl-propoxy]indole-3-carboxylate hydrochloride

Systemtic Name: ethyl 2-methyl-1-(4-methylphenyl)-5-[3-(4-methylpiperazin-1-yl)-2-oxidanyl-propoxy]indole-3-carboxylate hydrochloride Openeye Name: ethyl 5-[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]-2-methyl-1-(p-tolyl)indole-3-carboxylate hydrochloride CAS Name: 5-[2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy]-2-methyl-1-(4-methylphenyl)-3-indolecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 5-[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]-2-methyl-1-(4-methylphenyl)indole-3-carboxylate hydrochloride Traditional Name: 5-[2-hydroxy-3-(4-methylpiperazino)propoxy]-2-methyl-1-(p-tolyl)indole-3-carboxylic acid ethyl ester hydrochloride Formula: C27H36ClN3O4 MolecularWeight: 502.04544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3CCN(CC3)C)O)C4=CC=C(C=C4)C)C.Cl

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3CCN(CC3)C)O)C4=CC=C(C=C4)C)C.Cl

InChI

InChI=1S/C27H35N3O4.ClH/c1-5-33-27(32)26-20(3)30(21-8-6-19(2)7-9-21)25-11-10-23(16-24(25)26)34-18-22(31)17-29-14-12-28(4)13-15-29;/h6-11,16,22,31H,5,12-15,17-18H2,1-4H3;1H