(3R)-1-(4-ethylpiperazin-4-ium-1-yl)-3-(4-methylphenyl)-3-(5-nitro-1H-indol-3-yl)propan-1-one

Systemtic Name: (3R)-1-(4-ethylpiperazin-4-ium-1-yl)-3-(4-methylphenyl)-3-(5-nitro-1H-indol-3-yl)propan-1-one Openeye Name: (3R)-1-(4-ethylpiperazin-4-ium-1-yl)-3-(5-nitro-1H-indol-3-yl)-3-(p-tolyl)propan-1-one CAS Name: (3R)-1-(4-ethyl-1-piperazin-4-iumyl)-3-(4-methylphenyl)-3-(5-nitro-1H-indol-3-yl)-1-propanone IUPAC Name: (3R)-1-(4-ethylpiperazin-4-ium-1-yl)-3-(4-methylphenyl)-3-(5-nitro-1H-indol-3-yl)propan-1-one Traditional Name: (3R)-1-(4-ethylpiperazin-4-ium-1-yl)-3-(5-nitro-1H-indol-3-yl)-3-(p-tolyl)propan-1-one Formula: C24H29N4O3+ MolecularWeight: 421.51206

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CC(C2=CC=C(C=C2)C)C3=CNC4=C3C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C[C@H](C2=CC=C(C=C2)C)C3=CNC4=C3C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H28N4O3/c1-3-26-10-12-27(13-11-26)24(29)15-20(18-6-4-17(2)5-7-18)22-16-25-23-9-8-19(28(30)31)14-21(22)23/h4-9,14,16,20,25H,3,10-13,15H2,1-2H3/p+1/t20-/m1/s1