N-[(2S)-3-methyl-1-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]-1-oxidanylidene-butan-2-yl]-2-naphthalen-1-yl-ethanamide

Systemtic Name: N-[(2S)-3-methyl-1-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]-1-oxidanylidene-butan-2-yl]-2-naphthalen-1-yl-ethanamide Openeye Name: N-[(1S)-2-methyl-1-[4-(2-morpholino-2-oxo-ethyl)piperazin-4-ium-1-carbonyl]propyl]-2-(1-naphthyl)acetamide CAS Name: N-[(2S)-3-methyl-1-[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazin-4-iumyl]-1-oxobutan-2-yl]-2-(1-naphthalenyl)acetamide IUPAC Name: N-[(2S)-3-methyl-1-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-4-ium-1-yl]-1-oxobutan-2-yl]-2-naphthalen-1-ylacetamide Traditional Name: N-[(1S)-1-[4-(2-keto-2-morpholino-ethyl)piperazin-4-ium-1-carbonyl]-2-methyl-propyl]-2-(1-naphthyl)acetamide Formula: C27H37N4O4+ MolecularWeight: 481.60708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CC[NH+](CC1)CC(=O)N2CCOCC2)NC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CC[NH+](CC1)CC(=O)N2CCOCC2)NC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H36N4O4/c1-20(2)26(28-24(32)18-22-8-5-7-21-6-3-4-9-23(21)22)27(34)31-12-10-29(11-13-31)19-25(33)30-14-16-35-17-15-30/h3-9,20,26H,10-19H2,1-2H3,(H,28,32)/p+1/t26-/m0/s1