(2R)-2-[[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]amino]-N-(2-propan-2-ylphenyl)propanamide

Systemtic Name: (2R)-2-[[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]amino]-N-(2-propan-2-ylphenyl)propanamide Openeye Name: (2R)-2-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-anilino]-N-(2-isopropylphenyl)propanamide CAS Name: (2R)-2-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylanilino]-N-(2-propan-2-ylphenyl)propanamide IUPAC Name: (2R)-2-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylanilino]-N-(2-propan-2-ylphenyl)propanamide Traditional Name: (2R)-2-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-anilino]-N-o-cumenyl-propionamide Formula: C25H37N4O+ MolecularWeight: 409.58748

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(C)C(=O)NC3=CC=CC=C3C(C)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)N[C@H](C)C(=O)NC3=CC=CC=C3C(C)C)C

InChI

InChI=1S/C25H36N4O/c1-6-28-13-15-29(16-14-28)24-12-11-21(17-19(24)4)26-20(5)25(30)27-23-10-8-7-9-22(23)18(2)3/h7-12,17-18,20,26H,6,13-16H2,1-5H3,(H,27,30)/p+1/t20-/m1/s1