3-[3-(aminocarbonylamino)propyl]-5-(2-methylphenyl)-4,6-bis(oxidanylidene)-1-(2-phenylethenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 3-[3-(aminocarbonylamino)propyl]-5-(2-methylphenyl)-4,6-bis(oxidanylidene)-1-(2-phenylethenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-(o-tolyl)-4,6-dioxo-1-styryl-3-(3-ureidopropyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 3-[3-(carbamoylamino)propyl]-5-(2-methylphenyl)-4,6-dioxo-1-(2-phenylethenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 3-[3-(carbamoylamino)propyl]-5-(2-methylphenyl)-4,6-dioxo-1-(2-phenylethenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 4,6-diketo-5-(o-tolyl)-1-styryl-3-(3-ureidopropyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C26H28N4O5 MolecularWeight: 476.52432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3C(NC(C3C2=O)(CCCNC(=O)N)C(=O)O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3C(NC(C3C2=O)(CCCNC(=O)N)C(=O)O)C=CC4=CC=CC=C4

InChI

InChI=1S/C26H28N4O5/c1-16-8-5-6-11-19(16)30-22(31)20-18(13-12-17-9-3-2-4-10-17)29-26(24(33)34,21(20)23(30)32)14-7-15-28-25(27)35/h2-6,8-13,18,20-21,29H,7,14-15H2,1H3,(H,33,34)(H3,27,28,35)