2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]-1-(4-ethylpiperazin-4-ium-1-yl)ethanone

Systemtic Name: 2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]-1-(4-ethylpiperazin-4-ium-1-yl)ethanone Openeye Name: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-1-(4-ethylpiperazin-4-ium-1-yl)ethanone CAS Name: 2-[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]-1-(4-ethyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]-1-(4-ethylpiperazin-4-ium-1-yl)ethanone Traditional Name: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]-1-(4-ethylpiperazin-4-ium-1-yl)ethanone Formula: C25H29ClN3O3+ MolecularWeight: 454.96906

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CC2=C(N(C3=C2C=C(C=C3)OC)C(=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CC2=C(N(C3=C2C=C(C=C3)OC)C(=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C25H28ClN3O3/c1-4-27-11-13-28(14-12-27)24(30)16-21-17(2)29(23-10-9-20(32-3)15-22(21)23)25(31)18-5-7-19(26)8-6-18/h5-10,15H,4,11-14,16H2,1-3H3/p+1