3-[2,3-dimethyl-1,4-bis(oxidanylidene)-6,7,8,8a-tetrahydropyrrolo[1,2-a]pyrazin-3-yl]-2-phenyl-propanoic acid

Systemtic Name: 3-[2,3-dimethyl-1,4-bis(oxidanylidene)-6,7,8,8a-tetrahydropyrrolo[1,2-a]pyrazin-3-yl]-2-phenyl-propanoic acid Openeye Name: 3-(2,3-dimethyl-1,4-dioxo-6,7,8,8a-tetrahydropyrrolo[1,2-a]pyrazin-3-yl)-2-phenyl-propanoic acid CAS Name: 3-(2,3-dimethyl-1,4-dioxo-6,7,8,8a-tetrahydropyrrolo[1,2-a]pyrazin-3-yl)-2-phenylpropanoic acid IUPAC Name: 3-(2,3-dimethyl-1,4-dioxo-6,7,8,8a-tetrahydropyrrolo[1,2-a]pyrazin-3-yl)-2-phenylpropanoic acid Traditional Name: 3-(1,4-diketo-2,3-dimethyl-6,7,8,8a-tetrahydropyrrolo[1,2-a]pyrazin-3-yl)-2-phenyl-propionic acid Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N2CCCC2C(=O)N1C)CC(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1(C(=O)N2CCCC2C(=O)N1C)CC(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H22N2O4/c1-18(11-13(16(22)23)12-7-4-3-5-8-12)17(24)20-10-6-9-14(20)15(21)19(18)2/h3-5,7-8,13-14H,6,9-11H2,1-2H3,(H,22,23)