N-[(2S)-3-methyl-1-oxidanylidene-1-[4-(2-pyridin-4-ylethyl)piperazin-4-ium-1-yl]butan-2-yl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[(2S)-3-methyl-1-oxidanylidene-1-[4-(2-pyridin-4-ylethyl)piperazin-4-ium-1-yl]butan-2-yl]-2,2-diphenyl-ethanamide Openeye Name: N-[(1S)-2-methyl-1-[4-[2-(4-pyridyl)ethyl]piperazin-4-ium-1-carbonyl]propyl]-2,2-diphenyl-acetamide CAS Name: N-[(2S)-3-methyl-1-oxo-1-[4-(2-pyridin-4-ylethyl)-1-piperazin-4-iumyl]butan-2-yl]-2,2-diphenylacetamide IUPAC Name: N-[(2S)-3-methyl-1-oxo-1-[4-(2-pyridin-4-ylethyl)piperazin-4-ium-1-yl]butan-2-yl]-2,2-diphenylacetamide Traditional Name: N-[(1S)-2-methyl-1-[4-[2-(4-pyridyl)ethyl]piperazin-4-ium-1-carbonyl]propyl]-2,2-diphenyl-acetamide Formula: C30H37N4O2+ MolecularWeight: 485.64038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CC[NH+](CC1)CCC2=CC=NC=C2)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CC[NH+](CC1)CCC2=CC=NC=C2)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H36N4O2/c1-23(2)28(30(36)34-21-19-33(20-22-34)18-15-24-13-16-31-17-14-24)32-29(35)27(25-9-5-3-6-10-25)26-11-7-4-8-12-26/h3-14,16-17,23,27-28H,15,18-22H2,1-2H3,(H,32,35)/p+1/t28-/m0/s1