4-(4-carbamimidoylphenyl)-2-methyl-1,3-bis(oxidanylidene)-3a,4,6,7,8,8b-hexahydropyrrolo[3,4-a]pyrrolizine-8a-carboxylic acid

Systemtic Name: 4-(4-carbamimidoylphenyl)-2-methyl-1,3-bis(oxidanylidene)-3a,4,6,7,8,8b-hexahydropyrrolo[3,4-a]pyrrolizine-8a-carboxylic acid Openeye Name: 4-(4-carbamimidoylphenyl)-2-methyl-1,3-dioxo-3a,4,6,7,8,8b-hexahydropyrrolo[3,4-a]pyrrolizine-8a-carboxylic acid CAS Name: 4-(4-carbamimidoylphenyl)-2-methyl-1,3-dioxo-3a,4,6,7,8,8b-hexahydropyrrolo[3,4-a]pyrrolizine-8a-carboxylic acid IUPAC Name: 4-(4-carbamimidoylphenyl)-2-methyl-1,3-dioxo-3a,4,6,7,8,8b-hexahydropyrrolo[3,4-a]pyrrolizine-8a-carboxylic acid Traditional Name: 4-(4-amidinophenyl)-1,3-diketo-2-methyl-3a,4,6,7,8,8b-hexahydropyrrolo[3,4-a]pyrrolizine-8a-carboxylic acid Formula: C18H20N4O4 MolecularWeight: 356.3758

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2C(C1=O)C3(CCCN3C2C4=CC=C(C=C4)C(=N)N)C(=O)O

Isomeric SMILES

CN1C(=O)C2C(C1=O)C3(CCCN3C2C4=CC=C(C=C4)C(=N)N)C(=O)O

InChI

InChI=1S/C18H20N4O4/c1-21-15(23)11-12(16(21)24)18(17(25)26)7-2-8-22(18)13(11)9-3-5-10(6-4-9)14(19)20/h3-6,11-13H,2,7-8H2,1H3,(H3,19,20)(H,25,26)