1-(4-carbamimidoylphenyl)-5-(cyclohexylmethyl)-4,6-bis(oxidanylidene)-3-propan-2-yl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 1-(4-carbamimidoylphenyl)-5-(cyclohexylmethyl)-4,6-bis(oxidanylidene)-3-propan-2-yl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 1-(4-carbamimidoylphenyl)-5-(cyclohexylmethyl)-3-isopropyl-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 1-(4-carbamimidoylphenyl)-5-(cyclohexylmethyl)-4,6-dioxo-3-propan-2-yl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 1-(4-carbamimidoylphenyl)-5-(cyclohexylmethyl)-4,6-dioxo-3-propan-2-yl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 1-(4-amidinophenyl)-5-(cyclohexylmethyl)-3-isopropyl-4,6-diketo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C24H32N4O4 MolecularWeight: 440.53528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C2C(C(N1)C3=CC=C(C=C3)C(=N)N)C(=O)N(C2=O)CC4CCCCC4)C(=O)O

Isomeric SMILES

CC(C)C1(C2C(C(N1)C3=CC=C(C=C3)C(=N)N)C(=O)N(C2=O)CC4CCCCC4)C(=O)O

InChI

InChI=1S/C24H32N4O4/c1-13(2)24(23(31)32)18-17(19(27-24)15-8-10-16(11-9-15)20(25)26)21(29)28(22(18)30)12-14-6-4-3-5-7-14/h8-11,13-14,17-19,27H,3-7,12H2,1-2H3,(H3,25,26)(H,31,32)