3-(cyclohexylmethyl)-1-(3-methoxy-2-phenylmethoxy-phenyl)-4,6-bis(oxidanylidene)-5-(phenylmethyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 3-(cyclohexylmethyl)-1-(3-methoxy-2-phenylmethoxy-phenyl)-4,6-bis(oxidanylidene)-5-(phenylmethyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-benzyl-1-(2-benzyloxy-3-methoxy-phenyl)-3-(cyclohexylmethyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 3-(cyclohexylmethyl)-1-(3-methoxy-2-phenylmethoxyphenyl)-4,6-dioxo-5-(phenylmethyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-benzyl-3-(cyclohexylmethyl)-1-(3-methoxy-2-phenylmethoxyphenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 1-(2-benzoxy-3-methoxy-phenyl)-5-benzyl-3-(cyclohexylmethyl)-4,6-diketo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C35H38N2O6 MolecularWeight: 582.68602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC2=CC=CC=C2)C3C4C(C(=O)N(C4=O)CC5=CC=CC=C5)C(N3)(CC6CCCCC6)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1OCC2=CC=CC=C2)C3C4C(C(=O)N(C4=O)CC5=CC=CC=C5)C(N3)(CC6CCCCC6)C(=O)O

InChI

InChI=1S/C35H38N2O6/c1-42-27-19-11-18-26(31(27)43-22-25-16-9-4-10-17-25)30-28-29(33(39)37(32(28)38)21-24-14-7-3-8-15-24)35(36-30,34(40)41)20-23-12-5-2-6-13-23/h3-4,7-11,14-19,23,28-30,36H,2,5-6,12-13,20-22H2,1H3,(H,40,41)