1-(4-ethylpiperazin-4-ium-1-yl)-2-[1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)indol-3-yl]ethane-1,2-dione

Systemtic Name: 1-(4-ethylpiperazin-4-ium-1-yl)-2-[1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)indol-3-yl]ethane-1,2-dione Openeye Name: 1-(4-ethylpiperazin-4-ium-1-yl)-2-[1-(2-morpholino-2-oxo-ethyl)indol-3-yl]ethane-1,2-dione CAS Name: 1-(4-ethyl-1-piperazin-4-iumyl)-2-[1-[2-(4-morpholinyl)-2-oxoethyl]-3-indolyl]ethane-1,2-dione IUPAC Name: 1-(4-ethylpiperazin-4-ium-1-yl)-2-[1-(2-morpholin-4-yl-2-oxoethyl)indol-3-yl]ethane-1,2-dione Traditional Name: 1-(4-ethylpiperazin-4-ium-1-yl)-2-[1-(2-keto-2-morpholino-ethyl)indol-3-yl]ethane-1,2-dione Formula: C22H29N4O4+ MolecularWeight: 413.49006

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCOCC4

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCOCC4

InChI

InChI=1S/C22H28N4O4/c1-2-23-7-9-25(10-8-23)22(29)21(28)18-15-26(19-6-4-3-5-17(18)19)16-20(27)24-11-13-30-14-12-24/h3-6,15H,2,7-14,16H2,1H3/p+1