(2S,3R)-3-(4-ethylpiperazin-4-ium-1-yl)-1-(1H-indol-3-yl)-3-(4-methoxyphenyl)-2-oxidanyl-propan-1-one

Systemtic Name: (2S,3R)-3-(4-ethylpiperazin-4-ium-1-yl)-1-(1H-indol-3-yl)-3-(4-methoxyphenyl)-2-oxidanyl-propan-1-one Openeye Name: (2S,3R)-3-(4-ethylpiperazin-4-ium-1-yl)-2-hydroxy-1-(1H-indol-3-yl)-3-(4-methoxyphenyl)propan-1-one CAS Name: (2S,3R)-3-(4-ethyl-1-piperazin-4-iumyl)-2-hydroxy-1-(1H-indol-3-yl)-3-(4-methoxyphenyl)-1-propanone IUPAC Name: (2S,3R)-3-(4-ethylpiperazin-4-ium-1-yl)-2-hydroxy-1-(1H-indol-3-yl)-3-(4-methoxyphenyl)propan-1-one Traditional Name: (2S,3R)-3-(4-ethylpiperazin-4-ium-1-yl)-2-hydroxy-1-(1H-indol-3-yl)-3-(4-methoxyphenyl)propan-1-one Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(C2=CC=C(C=C2)OC)C(C(=O)C3=CNC4=CC=CC=C43)O

Isomeric SMILES

CC[NH+]1CCN(CC1)[C@H](C2=CC=C(C=C2)OC)[C@@H](C(=O)C3=CNC4=CC=CC=C43)O

InChI

InChI=1S/C24H29N3O3/c1-3-26-12-14-27(15-13-26)22(17-8-10-18(30-2)11-9-17)24(29)23(28)20-16-25-21-7-5-4-6-19(20)21/h4-11,16,22,24-25,29H,3,12-15H2,1-2H3/p+1/t22-,24+/m1/s1