4-methyl-2-[2-methyl-3-naphthalen-1-yl-5,6-bis(oxidanylidene)piperazin-1-yl]pentanoic acid

Systemtic Name: 4-methyl-2-[2-methyl-3-naphthalen-1-yl-5,6-bis(oxidanylidene)piperazin-1-yl]pentanoic acid Openeye Name: 4-methyl-2-[2-methyl-3-(1-naphthyl)-5,6-dioxo-piperazin-1-yl]pentanoic acid CAS Name: 4-methyl-2-[2-methyl-3-(1-naphthalenyl)-5,6-dioxo-1-piperazinyl]pentanoic acid IUPAC Name: 4-methyl-2-(2-methyl-3-naphthalen-1-yl-5,6-dioxopiperazin-1-yl)pentanoic acid Traditional Name: 2-[2,3-diketo-6-methyl-5-(1-naphthyl)piperazino]-4-methyl-valeric acid Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(NC(=O)C(=O)N1C(CC(C)C)C(=O)O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC1C(NC(=O)C(=O)N1C(CC(C)C)C(=O)O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H24N2O4/c1-12(2)11-17(21(26)27)23-13(3)18(22-19(24)20(23)25)16-10-6-8-14-7-4-5-9-15(14)16/h4-10,12-13,17-18H,11H2,1-3H3,(H,22,24)(H,26,27)